COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809738
Chemical Name: ethyl2-[(2,2,2-trichloro-1-{[(3-methylphenyl)carbonyl]amino}ethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)NC(C(Cl)(Cl)Cl)NC(=O)c1cccc(c1)C

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Molecular Weight: 489.85
Empirical Formula: C21H23Cl3N2O3S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 8.55
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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