COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL016998
Chemical Name: (2E)-N-[5-(3-chlorobenzyl)-1,3-thiazol-2-yl]-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)C(C)C)/C(=O)Nc1ncc(s1)Cc1cccc(c1)Cl

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Molecular Weight: 421.95
Empirical Formula: C23H20ClN3OS

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.498
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 94
Number of rings: 3

     

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