COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL113998
Chemical Name: methyl2-[({4-[(methylsulfonyl)(prop-2-en-1-yl)amino]phenyl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: C=CCN(S(=O)(=O)C)c1ccc(cc1)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 448.56
Empirical Formula: C21H24N2O5S2

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 5.653
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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