COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850256
Chemical Name: (2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl4-chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccnc1)/C2=O

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Molecular Weight: 413.84
Empirical Formula: C20H12ClNO5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.984
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 90
Number of rings: 4

     

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