Nevaltophin D

AlkaPlorer ID: AK037422

Synonym: None

IUPAC Name: N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]-N,3-dimethyl-2-oxopentanamide

Structure

SMILES: CCC(C)C(=O)C(=O)N(C)[C@H](C(O)=NCCC1=CNC2=CC=CC=C12)C(C)C

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InChI: InChI=1S/C22H31N3O3/c1-6-15(4)20(26)22(28)25(5)19(14(2)3)21(27)23-12-11-16-13-24-18-10-8-7-9-17(16)18/h7-10,13-15,19,24H,6,11-12H2,1-5H3,(H,23,27)/t15?,19-/m0/s1

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InChIKey: HLFLCRYVHOAXOU-FUBQLUNQSA-N

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Source

Properties Information

Molecule Weight: 385.5080000000001

TPSA: 85.75999999999999

MolLogP: 3.765100000000001

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information