COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL016795
Chemical Name: ethyl2-({(2E)-2-cyano-3-[1-(2-cyanoethyl)-1H-indol-3-yl]prop-2-enoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2cn(c3c2cccc3)CCC#N)/C#N)sc2c1CCC(C2)C

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Molecular Weight: 486.59
Empirical Formula: C27H26N4O3S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.316
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 136
Number of rings: 4

     

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