COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434224
Chemical Name: methyl2-{[(2E)-2-cyano-3-{4-[(2-fluorobenzyl)oxy]phenyl}prop-2-enoyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccc(cc1)OCc1ccccc1F)/C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N(C)C

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Molecular Weight: 521.57
Empirical Formula: C27H24FN3O5S

Physical State: Dry powder
Available Amount: 870 mg

Lipinsky:
logP: 6.389
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 136
Number of rings: 3

     

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