COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158512
Chemical Name: (2E)-2-{[(4-chlorobenzyl)amino]methylidene}-5-ethoxy-1-benzothiophen-3(2H)-one
Smiles: CCOc1ccc2c(c1)C(=O)/C(=C\NCc1ccc(cc1)Cl)/S2

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Molecular Weight: 345.85
Empirical Formula: C18H16ClNO2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.186
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 63
Number of rings: 3

     

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