COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK467778
Chemical Name: methyl5-ethyl-2-[({[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Smiles: C=CCn1c(SCC(=O)Nc2sc(cc2C(=O)OC)CC)nnc1c1ccncc1

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Molecular Weight: 443.55
Empirical Formula: C20H21N5O3S2

Physical State: Dry powder
Available Amount: 278 mg

Lipinsky:
logP: 4.979
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 152
Number of rings: 3

     

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