COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK303010
Chemical Name: methyl2-[({[4-butyl-5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCCCn1c(SCC(=O)Nc2sc3c(c2C(=O)OC)CCCC3)nnc1c1nn(cc1Cl)C

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Molecular Weight: 523.08
Empirical Formula: C22H27ClN6O3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.973
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 157
Number of rings: 4

     

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