COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457205
Chemical Name: 1-[4-(butan-2-yl)phenyl]-3-[3-nitro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]thiourea
Smiles: CCC(c1ccc(cc1)NC(=S)Nc1cc(OCC(C(F)F)(F)F)cc(c1)[N+](=O)[O-])C

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Molecular Weight: 459.46
Empirical Formula: C20H21F4N3O3S

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: 6.074
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 111
Number of rings: 2

     

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