COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL403445
Chemical Name: [(7Z)-7-benzylidene-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
Smiles: CCn1nc(c(c1)[N+](=O)[O-])C(=O)N1N=C2C(C1c1ccccc1)CCC/C/2=C/c1ccccc1

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Molecular Weight: 455.52
Empirical Formula: C26H25N5O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.778
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 5

     

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