COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK078292
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-({[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino}methylidene)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)N/C=C\1/C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2

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Molecular Weight: 535.57
Empirical Formula: C26H16F3N5OS2

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 8.46
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 126
Number of rings: 6

     

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