COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK254868
Chemical Name: N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-2-methoxy-3-methylbenzamide
Smiles: COc1c(C)cccc1C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 448.93
Empirical Formula: C20H21ClN4O4S

Physical State: Dry powder
Available Amount: 432 mg

Lipinsky:
logP: 3.682
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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