N'-(benzenesulfonyl)-2,2,2-trichloro-N-pyridin-4-ylethanimidamide

Formula:C13H10N3O2Cl3S Mutagenic:high Tumorigenic:low Reproductive Effective:high N'-(benzenesulfonyl)-2,2,2-trichloro-N-pyridin-4-ylethanimidamide is a drug-like molecule.

MolName	N'-(benzenesulfonyl)-2,2,2-trichloro-N-pyridin-4-ylethanimidamide
MolecularFormula	C13H10N3O2Cl3S
Smiles	O=S(c1ccccc1)(/N=C(\C(Cl)(Cl)Cl)/Nc1ccncc1)=O
InChI	InChI=1S/C13H10Cl3N3O2S/c14-13(15,16)12(18-10-6-8-17-9-7-10)19-22(20,21)11-4-2-1-3-5-11/h1-9H,(H,17,18,19)
InChIK	OFFVJKIMRHTROA-UHFFFAOYSA-N
TotalMolweight	378.666
Molweight	378.666
MonoisotopicMass	376.955928
CLogP	3.0095
CLogS	-3.456
H Acceptors	5
H Donors	1
TotalSurfaceArea	251.46
Relative PSA	0.24863
PolarSurfaceArea	79.8
Druglikeness	-6.5504
Mutagenic	high
Tumorigenic	low
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.54545
Fragments	1
Non HAtoms	22
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	7
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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