COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672499
Chemical Name: 2-(3-{2-[3-(2,5-dimethylphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione
Smiles: Cc1ccc(c(c1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])c1scc(n1)c1cccc(c1)N1C(=O)c2c(C1=O)cccc2)C

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Saltdata: HBr
Molecular Weight: 599.67
Empirical Formula: C34H25N5O4S

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 5.554
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 139
Number of rings: 7

     

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