COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK612773
Chemical Name: (2E)-1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one
Smiles: O=C(N1CCN(CC1)c1nsc2c1cccc2)/C=C/c1cccc(c1)C(F)(F)F

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Molecular Weight: 417.45
Empirical Formula: C21H18F3N3OS

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.098
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 64
Number of rings: 4

     

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