COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK147512
Chemical Name: 2-{[5-(4-nitrophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethanone
Smiles: C=CCn1c(SCC(=O)n2c3ccccc3c3c2CCCC3)nnc1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 473.56
Empirical Formula: C25H23N5O3S

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 7.444
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 123
Number of rings: 5

     

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