COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK242186
Chemical Name: 1-(1,2-dimethyl-1H-indol-3-yl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: C=CCn1c(SCC(=O)c2c(C)n(c3c2cccc3)C)nnc1c1ccncc1

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Molecular Weight: 403.51
Empirical Formula: C22H21N5OS

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 4.271
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 90
Number of rings: 4

     

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