COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK848206
Chemical Name: 2-chloro-N-{[(2E)-4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}-4-nitrobenzamide
Smiles: Cc1ccc(cc1)c1cs/c(=N/C(=S)NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])/[nH]1

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Molecular Weight: 432.91
Empirical Formula: C18H13ClN4O3S2

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 5.178
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 156
Number of rings: 3

     

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