COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK615595
Chemical Name: (2S)-{[(3R)-3-(4-chlorophenyl)-4-(L-prolylamino)butanoyl]amino}(phenyl)ethanoicacid
Smiles: O=C(N[C@@H](c1ccccc1)C(=O)O)CC(c1ccc(cc1)Cl)CNC(=O)[C@@H]1CCCN1

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Saltdata: HCl
Molecular Weight: 443.93
Empirical Formula: C23H26ClN3O4

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 1.824
Rotatable bonds: 6
H-donors: 4
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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