COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL015509
Chemical Name: (2E)-3-{5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoicacid
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(\C(=O)O)/Sc1nnc([nH]1)C

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Molecular Weight: 399.43
Empirical Formula: C19H17N3O5S

Physical State: Dry powder
Available Amount: 136 mg

Lipinsky:
logP: 4.837
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 143
Number of rings: 3

     

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