COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK668217
Chemical Name: O-{4-[(3-nitrophenyl)carbamoyl]phenyl}(3-nitrophenyl)carbamothioate
Smiles: S=C(Nc1cccc(c1)[N+](=O)[O-])Oc1ccc(cc1)C(=O)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 438.42
Empirical Formula: C20H14N4O6S

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 5.257
Rotatable bonds: 1
H-donors: 2
H-acceptors: 6
PSA: 174
Number of rings: 3

     

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