COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049304
Chemical Name: (2E)-3-(9-ethyl-9H-carbazol-3-yl)-2-[(3-methyl-1H-1,2,4-triazol-4-ium-5-yl)sulfanyl]prop-2-enoate
Smiles: CCn1c2ccc(cc2c2c1cccc2)/C=C(\C(=O)[O-])/Sc1[nH]nc([nH+]1)C

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Molecular Weight: 378.45
Empirical Formula: C20H18N4O2S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 5.332
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 113
Number of rings: 4

     

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