COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK267122
Chemical Name: 2-{[5-(3,4-dimethoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-methoxyphenyl)ethanone
Smiles: C=CCn1c(SCC(=O)c2cccc(c2)OC)nnc1c1ccc(c(c1)OC)OC

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Molecular Weight: 425.51
Empirical Formula: C22H23N3O4S

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 5.584
Rotatable bonds: 10
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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