COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK730237
Chemical Name: (2E)-N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Smiles: CCC(=O)Nc1ccc(c(c1)NC(=S)NC(=O)/C=C/c1ccc(cc1)C(C)C)Cl

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Molecular Weight: 429.97
Empirical Formula: C22H24ClN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.96
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 102
Number of rings: 2

     

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