COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK088275
Chemical Name: N-{[3-(1,3-benzoxazol-2-yl)-4-chlorophenyl]carbamothioyl}-4-nitrobenzamide
Smiles: S=C(NC(=O)c1ccc(cc1)[N+](=O)[O-])Nc1ccc(c(c1)c1nc2c(o1)cccc2)Cl

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Molecular Weight: 452.88
Empirical Formula: C21H13ClN4O4S

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 5.487
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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