COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK069680
Chemical Name: 1-(4-methoxyphenyl)-3-(2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl)thiourea
Smiles: COc1ccc(cc1)NC(=S)NCCNc1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 414.41
Empirical Formula: C17H17F3N4O3S

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 3.913
Rotatable bonds: 3
H-donors: 3
H-acceptors: 3
PSA: 123
Number of rings: 2

     

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