COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455595
Chemical Name: 1-(2-methoxy-4-nitrophenyl)-3-[4-(piperidin-1-ylcarbonyl)phenyl]thiourea
Smiles: COc1cc(ccc1NC(=S)Nc1ccc(cc1)C(=O)N1CCCCC1)[N+](=O)[O-]

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Molecular Weight: 414.49
Empirical Formula: C20H22N4O4S

Physical State: Dry powder
Available Amount: 485 mg

Lipinsky:
logP: 2.651
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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