COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK100169
Chemical Name: (4E)-4-[(9-ethyl-9H-carbazol-3-yl)methylidene]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCn1c2ccc(cc2c2c1cccc2)/C=C/1\C(=NN(C1=O)c1scc(n1)c1ccc(cc1)C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 583.67
Empirical Formula: C34H25N5O3S

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 8.485
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 7

     

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