COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK398886
Chemical Name: N-{[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]carbamothioyl}-3-nitro-4-(piperidin-1-yl)benzamide
Smiles: S=C(NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCCC1)Nc1ccc(c(c1)Cl)c1cc2ccccc2oc1=O

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Molecular Weight: 563.03
Empirical Formula: C28H23ClN4O5S

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 7.318
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 148
Number of rings: 5

     

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