COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL430959
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-(6-chloro-1,3-benzodioxol-5-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc2OCOc2cc1Cl)/c1nc2c([nH]1)cccc2

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Molecular Weight: 323.74
Empirical Formula: C17H10ClN3O2

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 4.591
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 4

     

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