COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK868467
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(furan-2-ylmethyl)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)/NCc1ccco1

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Molecular Weight: 406.39
Empirical Formula: C18H13F3N4O2S

Physical State: Dry powder
Available Amount: 718 mg

Lipinsky:
logP: 5.777
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 98
Number of rings: 4

     

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