Cularidine

AlkaPlorer ID: AK043256

Synonym: None

IUPAC Name: (10S)-5,6-dimethoxy-11-methyl-2-oxa-11-azatetracyclo[8.7.1.03,8.014,18]octadeca-1(17),3,5,7,14(18),15-hexaen-17-ol

Structure

SMILES: COC1=CC2=C(C=C1OC)OC1=C(O)C=CC3=C1[C@H](C2)N(C)CC3

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InChI: InChI=1S/C19H21NO4/c1-20-7-6-11-4-5-14(21)19-18(11)13(20)8-12-9-16(22-2)17(23-3)10-15(12)24-19/h4-5,9-10,13,21H,6-8H2,1-3H3/t13-/m0/s1

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InChIKey: ITGZZZYNPULRNZ-ZDUSSCGKSA-N

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Source

Properties Information

Molecule Weight: 327.3800000000001

TPSA: 51.16

MolLogP: 3.286800000000002

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Rattus norvegicus Dopamine D1 receptor IC50 800.0 nM 10.1021/jm060959i
Rattus norvegicus Dopamine D2 receptor IC50 300.0 nM 10.1021/jm060959i
Rattus norvegicus Dopamine transporter IC50 41000.0 nM 10.1021/jm060959i
Rattus norvegicus Dopamine transporter IC50 41200.0 nM 10.1021/np50124a001
None Unchecked Ratio IC50 0.002 None 10.1021/np50124a001
None Unchecked Ratio IC50 0.008 None 10.1021/np50124a001

Metabolism Information