COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473736
Chemical Name: methyl2-[({[4-ethyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nnc(n2CC)Cc2cccs2)sc2c1CCCC2

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Molecular Weight: 476.64
Empirical Formula: C21H24N4O3S3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 5.903
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 167
Number of rings: 4

     

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