COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK431307
Chemical Name: (2E)-3-(6-chloro-1,3-benzodioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1cc2OCOc2cc1Cl)/C(=O)Nc1cc(Cl)ccc1OC

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Molecular Weight: 391.21
Empirical Formula: C18H12Cl2N2O4

Physical State: Dry powder
Available Amount: 577 mg

Lipinsky:
logP: 4.915
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 80
Number of rings: 3

     

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