COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK012772
Chemical Name: 1-(4-chlorophenyl)-3-(2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl)thiourea
Smiles: S=C(Nc1ccc(cc1)Cl)NCCNc1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 418.83
Empirical Formula: C16H14ClF3N4O2S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.954
Rotatable bonds: 3
H-donors: 3
H-acceptors: 2
PSA: 114
Number of rings: 2

     

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