COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169405
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-(1-{[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]amino}ethylidene)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: C/C(=C/1\C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)/NC(C12CC3CC(C2)CC(C1)C3)C

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Molecular Weight: 488.58
Empirical Formula: C25H27F3N4OS

Available Amount: 0 mg

Lipinsky:
logP: 8.493
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 7

     

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