COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK347587
Chemical Name: N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}-1,3-benzodioxole-5-carboxamide
Smiles: S=C(Nc1cc(ccc1N1CCCC1)C(F)(F)F)NC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 437.44
Empirical Formula: C20H18F3N3O3S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.456
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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