COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206732
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-({[2-(2-methyl-1H-indol-3-yl)ethyl]amino}methylidene)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(/C/1=C\NCCc1c(C)[nH]c2c1cccc2)C(F)(F)F)c1nc2c(s1)cccc2

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Molecular Weight: 469.49
Empirical Formula: C23H18F3N5OS

Physical State: Dry powder
Available Amount: 175 mg

Lipinsky:
logP: 6.756
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 101
Number of rings: 5

     

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