COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL398987
Chemical Name: [(7Z)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylidene)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl}methanone
Smiles: O=C(N1N=C2C(C1c1ccc3c(c1)OCO3)CCC/C/2=C/c1ccc2c(c1)OCO2)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)C(C)C

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Molecular Weight: 707.71
Empirical Formula: C39H32F3N5O5

Physical State: Dry powder
Available Amount: 17 mg

Lipinsky:
logP: 7.661
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 99
Number of rings: 9

     

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