COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139630
Chemical Name: ethyl2-[({[5-({[(2-fluorophenyl)carbonyl]amino}methyl)-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: C=CCn1c(SCC(=O)Nc2sc3c(c2C(=O)OCC)CCCC3)nnc1CNC(=O)c1ccccc1F

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Molecular Weight: 557.67
Empirical Formula: C26H28FN5O4S2

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 5.727
Rotatable bonds: 11
H-donors: 2
H-acceptors: 4
PSA: 168
Number of rings: 4

     

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