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name Structure Reference Source Properties Activities Metabolism

Murrayaquinone A

AlkaPlorer ID: AK028588

Synonym: None

IUPAC Name: 3-methyl-9H-carbazole-1,4-dione

Structure

SMILES: CC1=CC(=O)C2=C(C1=O)C1=CC=CC=C1N2

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InChI: InChI=1S/C13H9NO2/c1-7-6-10(15)12-11(13(7)16)8-4-2-3-5-9(8)14-12/h2-6,14H,1H3

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InChIKey: XJTABSPWPMYLQX-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Murraya euchrestifolia Murraya Rutaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 211.22000000000003

TPSA？: 49.93

MolLogP？: 2.4932

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens 786-0 GI50 4265.8 nM 10.1021/np000020e
Homo sapiens 786-0 GI50 4265.8 nM None
Homo sapiens A549 GI50 25003.45 nM None
Homo sapiens A549 GI50 25118.86 nM 10.1021/np000020e
Homo sapiens ACHN GI50 4140.0 nM None
Homo sapiens ACHN GI50 4168.69 nM 10.1021/np000020e
Homo sapiens CAKI-1 GI50 14387.99 nM None
Homo sapiens CAKI-1 GI50 14454.4 nM 10.1021/np000020e
Homo sapiens CCRF-CEM GI50 3311.31 nM 10.1021/np000020e
Homo sapiens CCRF-CEM GI50 3334.26 nM None
Homo sapiens COLO 205 ED50 3.85 ug ml-1 10.1021/np000020e
Homo sapiens COLO 205 GI50 4073.8 nM 10.1021/np000020e
Homo sapiens COLO 205 GI50 4120.98 nM None
Homo sapiens DLD-1 GI50 5011.87 nM 10.1021/np000020e
Homo sapiens DLD-1 GI50 5069.91 nM None
Homo sapiens DMS-114 GI50 4255.98 nM None
Homo sapiens DMS-273 GI50 4255.98 nM None
Homo sapiens DMS-273 GI50 4265.8 nM 10.1021/np000020e
Homo sapiens EKVX GI50 4036.45 nM None
Homo sapiens EKVX GI50 4073.8 nM 10.1021/np000020e
Homo sapiens HCC 2998 GI50 6998.42 nM None
Homo sapiens HCC 2998 GI50 7079.46 nM 10.1021/np000020e
Homo sapiens HCT-116 GI50 4436.09 nM None
Homo sapiens HCT-116 GI50 4466.84 nM 10.1021/np000020e
Homo sapiens HCT-116 IC50 3716.0 nM 10.1016/j.ejmech.2016.05.065
Homo sapiens HCT-15 GI50 4168.69 nM 10.1021/np000020e
Homo sapiens HCT-15 GI50 4197.59 nM None
Homo sapiens HCT-8 ED50 5.5 ug ml-1 10.1021/np000020e
Homo sapiens HeLa EC50 13000.0 nM 10.1016/j.bmcl.2006.09.090
Homo sapiens HL-60 Activity 20.0 % 10.1016/j.bmcl.2019.06.038
Homo sapiens HL-60 Activity nan None 10.1016/j.bmcl.2019.06.038
Homo sapiens HL-60 FC 2.3 None 10.1016/j.bmcl.2019.06.038
Homo sapiens HL-60 GI50 4055.09 nM None
Homo sapiens HL-60 IC50 730.0 nM 10.1016/j.bmcl.2019.06.038
Homo sapiens HL-60 IC50 3022.0 nM 10.1016/j.ejmech.2016.05.065
Homo sapiens HL-60 Ratio IC50 100.0 None 10.1016/j.bmcl.2019.06.038
Homo sapiens HOP-18 GI50 3349.65 nM None
Homo sapiens HOP-18 GI50 3388.44 nM 10.1021/np000020e
Homo sapiens HOP-62 GI50 25003.45 nM None
Homo sapiens HOP-62 GI50 25118.86 nM 10.1021/np000020e
Homo sapiens HOP-92 GI50 3981.07 nM 10.1021/np000020e
Homo sapiens HOP-92 GI50 3981.07 nM None
Homo sapiens HT-29 GI50 17619.76 nM None
Homo sapiens HT-29 GI50 17782.79 nM 10.1021/np000020e
Homo sapiens IGROV-1 GI50 6606.93 nM 10.1021/np000020e
Homo sapiens IGROV-1 GI50 6622.17 nM None
Homo sapiens K562 GI50 5559.04 nM None
Homo sapiens K562 GI50 5623.41 nM 10.1021/np000020e
Homo sapiens KB ED50 5.18 ug ml-1 10.1021/np000020e
Homo sapiens KM12 GI50 4365.16 nM 10.1021/np000020e
Homo sapiens KM12 GI50 4395.42 nM None
Homo sapiens KM-20L2 GI50 25003.45 nM None
Homo sapiens KM-20L2 GI50 25118.86 nM 10.1021/np000020e
Homo sapiens LXFL 529 GI50 4216.97 nM None
Homo sapiens M14 GI50 4168.69 nM 10.1021/np000020e
Homo sapiens M14 GI50 4207.27 nM None
Homo sapiens M19-MEL GI50 3715.35 nM 10.1021/np000020e
Homo sapiens M19-MEL GI50 3715.35 nM None
Homo sapiens Malme-3M GI50 4852.89 nM None
Homo sapiens Malme-3M GI50 4897.79 nM 10.1021/np000020e
Homo sapiens MOLT-4 GI50 5357.97 nM None
Homo sapiens MOLT-4 GI50 5370.32 nM 10.1021/np000020e
Homo sapiens NCI-H226 GI50 6531.31 nM None
Homo sapiens NCI-H226 GI50 6606.93 nM 10.1021/np000020e
Homo sapiens NCI-H23 GI50 3689.78 nM None
Homo sapiens NCI-H23 GI50 3715.35 nM 10.1021/np000020e
Homo sapiens NCI-H322M GI50 25003.45 nM None
Homo sapiens NCI-H322M GI50 25118.86 nM 10.1021/np000020e
Homo sapiens NCI-H460 GI50 8109.61 nM None
Homo sapiens NCI-H460 GI50 8128.31 nM 10.1021/np000020e
Homo sapiens NCI-H522 GI50 3801.89 nM 10.1021/np000020e
Homo sapiens NCI-H522 GI50 3819.44 nM None
Homo sapiens OVCAR-3 GI50 4528.98 nM None
Homo sapiens OVCAR-4 GI50 4159.11 nM None
Homo sapiens OVCAR-5 GI50 5395.11 nM None
Homo sapiens OVCAR-8 GI50 4017.91 nM None
Homo sapiens RPMI-8226 GI50 5956.62 nM None
Homo sapiens RXF 393 GI50 3467.37 nM 10.1021/np000020e
Homo sapiens RXF 393 GI50 3475.36 nM None
Homo sapiens SF-268 GI50 4365.16 nM 10.1021/np000020e
Homo sapiens SF-268 GI50 4365.16 nM None
Homo sapiens SF-295 GI50 4315.19 nM None
Homo sapiens SF-295 GI50 4365.16 nM 10.1021/np000020e
Homo sapiens SF-539 GI50 4265.8 nM 10.1021/np000020e
Homo sapiens SF-539 GI50 4285.49 nM None
Homo sapiens SK-MEL-2 GI50 5370.32 nM 10.1021/np000020e
Homo sapiens SK-MEL-2 GI50 5370.32 nM None
Homo sapiens SK-MEL-28 GI50 4466.84 nM 10.1021/np000020e
Homo sapiens SK-MEL-28 GI50 4477.13 nM None
Homo sapiens SK-MEL-5 ED50 2.58 ug ml-1 10.1021/np000020e
Homo sapiens SK-MEL-5 GI50 4216.97 nM None
Homo sapiens SK-MEL-5 GI50 4265.8 nM 10.1021/np000020e
Homo sapiens SK-OV-3 GI50 20892.96 nM 10.1021/np000020e
Homo sapiens SK-OV-3 GI50 21134.89 nM None
Homo sapiens SN12C GI50 4570.88 nM 10.1021/np000020e
Homo sapiens SN12C GI50 4591.98 nM None
Homo sapiens SNB-19 GI50 25003.45 nM None
Homo sapiens SNB-19 GI50 25118.86 nM 10.1021/np000020e
Homo sapiens SNB-75 GI50 4355.12 nM None
Homo sapiens SNB-75 GI50 4365.16 nM 10.1021/np000020e
Homo sapiens SR GI50 5714.79 nM None
Homo sapiens SR GI50 5754.4 nM 10.1021/np000020e
Homo sapiens SW-620 GI50 3935.5 nM None
Homo sapiens SW-620 GI50 3981.07 nM 10.1021/np000020e
Homo sapiens TK-10 GI50 5011.87 nM 10.1021/np000020e
Homo sapiens TK-10 GI50 5035.01 nM None
Homo sapiens U-251 GI50 15452.54 nM None
Homo sapiens U-251 GI50 15488.17 nM 10.1021/np000020e
Homo sapiens UACC-257 GI50 4570.88 nM 10.1021/np000020e
Homo sapiens UACC-257 GI50 4570.88 nM None
Homo sapiens UACC-62 GI50 4168.69 nM 10.1021/np000020e
Homo sapiens UACC-62 GI50 4207.27 nM None
Homo sapiens UO-31 GI50 3981.07 nM 10.1021/np000020e
Homo sapiens UO-31 GI50 3999.45 nM None
Homo sapiens XF498 GI50 4365.16 nM 10.1021/np000020e
Homo sapiens XF498 GI50 4375.22 nM None
Mus musculus P388 EC50 2300.0 nM 10.1016/j.bmcl.2006.09.090
None ADMET EC50 10000.0 nM 10.1016/j.bmcl.2006.09.090
None NON-PROTEIN TARGET GI50 3981.07 nM 10.1021/np000020e
None NON-PROTEIN TARGET GI50 4073.8 nM 10.1021/np000020e
None NON-PROTEIN TARGET GI50 4168.69 nM 10.1021/np000020e
None NON-PROTEIN TARGET GI50 4265.8 nM 10.1021/np000020e
None NON-PROTEIN TARGET GI50 4570.88 nM 10.1021/np000020e
None NON-PROTEIN TARGET GI50 5370.32 nM 10.1021/np000020e
None NON-PROTEIN TARGET GI50 5888.44 nM 10.1021/np000020e

Metabolism Information