COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505905
Chemical Name: (2E)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoicacid
Smiles: Clc1ccc(c(c1)Cl)c1ccc(o1)/C=C(\C(=O)O)/Sc1nnc([nH]1)C

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Molecular Weight: 396.25
Empirical Formula: C16H11Cl2N3O3S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 5.499
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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