COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534920
Chemical Name: (2S)-{[(3R)-3-(4-chlorophenyl)-4-{[(4R)-1,3-thiazolidin-4-ylcarbonyl]amino}butanoyl]amino}(phenyl)ethanoicacid
Smiles: O=C(N[C@@H](c1ccccc1)C(=O)O)CC(c1ccc(cc1)Cl)CNC(=O)[C@H]1NCSC1

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Saltdata: HCl
Molecular Weight: 461.97
Empirical Formula: C22H24ClN3O4S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.001
Rotatable bonds: 5
H-donors: 4
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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