COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK385169
Chemical Name: 6-tert-butyl-2-{[(E)-(3-nitrophenyl)methylidene]amino}-N-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(c1c(/N=C/c2cccc(c2)[N+](=O)[O-])sc2c1CCC(C2)C(C)(C)C)Nc1cccc(c1)C(F)(F)F

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Molecular Weight: 529.58
Empirical Formula: C27H26F3N3O3S

Physical State: Dry powder
Available Amount: 602 mg

Lipinsky:
logP: 8.452
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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