(5Z)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-2-pyridin-4-yl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

Formula:C25H16N6OS Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-2-pyridin-4-yl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is a drug-like molecule.

MolName	(5Z)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-2-pyridin-4-yl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
MolecularFormula	C25H16N6OS
Smiles	O=C1n2nc(-c3ccncc3)nc2S/C1=C\c1cn(-c2ccccc2)nc1-c1ccccc1
InChI	InChI=1S/C25H16N6OS/c32-24-21(33-25-27-23(29-31(24)25)18-11-13-26-14-12-18)15-19-16-30(20-9-5-2-6-10-20)28-22(19)17-7-3-1-4-8-17/h1-16H
InChIK	RILSBMJSGIXSTK-UHFFFAOYSA-N
TotalMolweight	448.509
Molweight	448.509
MonoisotopicMass	448.110629
CLogP	3.2735
CLogS	-6.268
H Acceptors	7
TotalSurfaceArea	332.19
Relative PSA	0.26536
PolarSurfaceArea	103.79
Druglikeness	4.8104
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	28
Sp3Atoms	1
Symmetricatoms	6
Aromatic Nitrogens	6
StereoCon

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1 - (5Z)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-2-pyridin-4-yl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one | 2 - (5Z)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-2-pyridin-4-yl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

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