COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL024900
Chemical Name: ethyl4-({[5-(2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzoate
Smiles: C=CCn1c(SCc2ccc(cc2)C(=O)OCC)nnc1c1ccccc1O

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Molecular Weight: 395.48
Empirical Formula: C21H21N3O3S

Available Amount: 0 mg

Lipinsky:
logP: 6.247
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 3

     

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