N-[(Z)-(3-bromophenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine

Formula:C14H10N3O2BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(3-bromophenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine is a drug-like molecule.

MolName	N-[(Z)-(3-bromophenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine
MolecularFormula	C14H10N3O2BrS
Smiles	O=S(c1c2cccc1)(N=C2N/N=C\c1cccc(Br)c1)=O
InChI	InChI=1S/C14H10BrN3O2S/c15-11-5-3-4-10(8-11)9-16-17-14-12-6-1-2-7-13(12)21(19,20)18-14/h1-9H,(H,17,18)
InChIK	ZEDQYQFLIBEOPA-UHFFFAOYSA-N
TotalMolweight	364.222
Molweight	364.222
MonoisotopicMass	362.967708
CLogP	3.5647
CLogS	-4.561
H Acceptors	5
H Donors	1
TotalSurfaceArea	225.92
Relative PSA	0.27913
PolarSurfaceArea	79.27
Druglikeness	-0.22282
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	1
BasicNitrogens	1
StereoCon

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