COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL297346
Chemical Name: ethyl2-[({[5-(2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC=C)c2ccccc2O)sc2c1CCCC2

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Molecular Weight: 498.63
Empirical Formula: C24H26N4O4S2

Physical State: Dry powder
Available Amount: 955 mg

Lipinsky:
logP: 7.734
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 159
Number of rings: 4

     

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