COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK415216
Chemical Name: (2E)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-cyclohexylprop-2-enamide
Smiles: N#C/C(=C\c1cc2OCOc2cc1Cl)/C(=O)NC1CCCCC1

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Molecular Weight: 332.79
Empirical Formula: C17H17ClN2O3

Physical State: Dry powder
Available Amount: 1253 mg

Lipinsky:
logP: 3.794
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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