COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK993710
Chemical Name: (7Z)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylidene)-2-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole
Smiles: c1ccc(cc1)N1N=C2C(C1c1ccc3c(c1)OCO3)CCC/C/2=C/c1ccc2c(c1)OCO2

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Molecular Weight: 452.51
Empirical Formula: C28H24N2O4

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 5.825
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 52
Number of rings: 7

     

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