COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455404
Chemical Name: 1-(4-chloro-2,5-dimethoxyphenyl)-3-(2-methoxy-4-nitrophenyl)thiourea
Smiles: COc1cc(ccc1NC(=S)Nc1cc(OC)c(cc1OC)Cl)[N+](=O)[O-]

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Molecular Weight: 397.84
Empirical Formula: C16H16ClN3O5S

Physical State: Dry powder
Available Amount: 290 mg

Lipinsky:
logP: 4.377
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 129
Number of rings: 2

     

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