COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK727638
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}prop-2-enenitrile
Smiles: COc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F)/C=C(/c1nc2c([nH]1)cccc2)\C#N

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Molecular Weight: 480.4
Empirical Formula: C24H15F3N4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.44
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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