4-carbamoyl-2-[2-(1H-indol-3-yl)acetamido]butanoic acid

AlkaPlorer ID: AK319651

Synonym: None

IUPAC Name: 5-amino-2-[[2-(1H-indol-3-yl)acetyl]amino]-5-oxopentanoic acid

Structure

SMILES: NC(=O)CCC(NC(=O)CC1=CNC2=CC=CC=C12)C(=O)O

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InChI: InChI=1S/C15H17N3O4/c16-13(19)6-5-12(15(21)22)18-14(20)7-9-8-17-11-4-2-1-3-10(9)11/h1-4,8,12,17H,5-7H2,(H2,16,19)(H,18,20)(H,21,22)

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InChIKey: DVJIJAYHBZALOJ-UHFFFAOYSA-N

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Reference

PubChem CID: 25200879

NPASS: NPC282754

COCONUT: CNP0267374.1

Properties Information

Molecule Weight: 303.3180000000001

TPSA: 125.28

MolLogP: 0.5452999999999992

Number of H-Donors: 4

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information