COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK726711
Chemical Name: methyl2-[(2,2,2-trichloro-1-{[(4-methoxyphenyl)carbonyl]amino}ethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COc1ccc(cc1)C(=O)NC(C(Cl)(Cl)Cl)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 491.82
Empirical Formula: C20H21Cl3N2O4S

Physical State: Dry powder
Available Amount: 275 mg

Lipinsky:
logP: 7.725
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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