1,1-dioxo-N-[(Z)-pyridin-4-ylmethylideneamino]-1,2-benzothiazol-3-amine

Formula:C13H10N4O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 1,1-dioxo-N-[(Z)-pyridin-4-ylmethylideneamino]-1,2-benzothiazol-3-amine is a drug-like molecule.

MolName	1,1-dioxo-N-[(Z)-pyridin-4-ylmethylideneamino]-1,2-benzothiazol-3-amine
MolecularFormula	C13H10N4O2S
Smiles	O=S(c1c2cccc1)(N=C2N/N=C\c1ccncc1)=O
InChI	InChI=1S/C13H10N4O2S/c18-20(19)12-4-2-1-3-11(12)13(17-20)16-15-9-10-5-7-14-8-6-10/h1-9H,(H,16,17)
InChIK	CGSZSMKXBOZPLX-UHFFFAOYSA-N
TotalMolweight	286.314
Molweight	286.314
MonoisotopicMass	286.052446
CLogP	1.8386
CLogS	-2.932
H Acceptors	6
H Donors	1
TotalSurfaceArea	206.05
Relative PSA	0.35928
PolarSurfaceArea	92.16
Druglikeness	2.8331
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	3
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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