COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049026
Chemical Name: 1-(3,4-dihydroxyphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)c1ccc(c(c1)O)O

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Molecular Weight: 437.48
Empirical Formula: C22H19N3O5S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 5.065
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 135
Number of rings: 4

     

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