COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185231
Chemical Name: (2E)-3-(2-bromo-4-hydroxy-5-methoxyphenyl)-N-(3-chloro-2-methylphenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1cc(OC)c(cc1Br)O)/C(=O)Nc1cccc(c1C)Cl

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Molecular Weight: 421.68
Empirical Formula: C18H14BrClN2O3

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 5.39
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 82
Number of rings: 2

     

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