COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK354375
Chemical Name: ethyl(2E)-3-[(7Z)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]but-2-enoate
Smiles: CCOC(=O)/C=C(/N1N=C2C(C1c1ccc(cc1)F)CCC/C/2=C/c1ccc(cc1)F)\C

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Molecular Weight: 436.5
Empirical Formula: C26H26F2N2O2

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 5.363
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 4

     

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