COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472678
Chemical Name: methyl2-{[(2E)-2-cyano-3-{2-[(2,6-dichlorobenzyl)oxy]phenyl}prop-2-enoyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccccc1OCc1c(Cl)cccc1Cl)/C(=O)Nc1sc(cc1C(=O)OC)C(C)C

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Molecular Weight: 529.44
Empirical Formula: C26H22Cl2N2O4S

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 8.997
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 3

     

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