1-[2-({1-[2-(2-amino-4-methylpentanamido)-3-(1H-indol-3-yl)propanoyl]pyrrolidin-2-yl}formamido)-3-phenylpropanoyl]-5-oxopyrrolidine-2-carboxylic acid
AlkaPlorer ID: AK247337
Synonym: None
IUPAC Name: 1-[2-[[1-[2-[(2-amino-4-methylpentanoyl)amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]-5-oxopyrrolidine-2-carboxylic acid
Structure
SMILES: CC(C)CC(N)C(O)=NC(CC1=CNC2=CC=CC=C12)C(=O)N1CCCC1C(O)=NC(CC1=CC=CC=C1)C(=O)N1C(=O)CCC1C(=O)O
InChI: InChI=1S/C36H44N6O7/c1-21(2)17-25(37)32(44)39-28(19-23-20-38-26-12-7-6-11-24(23)26)34(46)41-16-8-13-29(41)33(45)40-27(18-22-9-4-3-5-10-22)35(47)42-30(36(48)49)14-15-31(42)43/h3-7,9-12,20-21,25,27-30,38H,8,13-19,37H2,1-2H3,(H,39,44)(H,40,45)(H,48,49)
InChIKey: XLAQITNWJKTPHN-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 672.7830000000002
TPSA？: 201.98
MolLogP？: 3.5699000000000023
Number of H-Donors: 5
Number of H-Acceptors: 7
RingCount: 5
Activities Information
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