1-(2-{[1-(2-amino-3-phenylpropanoyl)pyrrolidin-2-yl]formamido}-3-(1H-indol-3-yl)propanoyl)pyrrolidine-2-carboxylic acid
AlkaPlorer ID: AK072625
Synonym: None
IUPAC Name: 1-[2-[[1-(2-amino-3-phenylpropanoyl)pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid
Structure
SMILES: NC(CC1=CC=CC=C1)C(=O)N1CCCC1C(O)=NC(CC1=CNC2=CC=CC=C12)C(=O)N1CCCC1C(=O)O
InChI: InChI=1S/C30H35N5O5/c31-22(16-19-8-2-1-3-9-19)28(37)34-14-6-12-25(34)27(36)33-24(29(38)35-15-7-13-26(35)30(39)40)17-20-18-32-23-11-5-4-10-21(20)23/h1-5,8-11,18,22,24-26,32H,6-7,12-17,31H2,(H,33,36)(H,39,40)
InChIKey: RNBWDDXYITUWJR-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 545.6400000000003
TPSA?: 152.32
MolLogP?: 2.6720999999999995
Number of H-Donors: 4
Number of H-Acceptors: 5
RingCount: 5
Activities Information
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