N'-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]-2-pyridin-2-ylsulfanylethanimidamide

Formula:C13H11N5ClF3S Mutagenic:none Tumorigenic:high Reproductive Effective:low N'-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]-2-pyridin-2-ylsulfanylethanimidamide is a drug-like molecule.

MolName	N'-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]-2-pyridin-2-ylsulfanylethanimidamide
MolecularFormula	C13H11N5ClF3S
Smiles	N/C(/CSc1ncccc1)=N/Nc(ncc(C(F)(F)F)c1)c1Cl
InChI	InChI=1S/C13H11ClF3N5S/c14-9-5-8(13(15,16)17)6-20-12(9)22-21-10(18)7-23-11-3-1-2-4-19-11/h1-6H,7H2,(H2,18,21)(H,20,22)
InChIK	SBJHWWNMKYSGPM-UHFFFAOYSA-N
TotalMolweight	361.778
Molweight	361.778
MonoisotopicMass	361.037576
CLogP	4.109
CLogS	-3.668
H Acceptors	5
H Donors	2
TotalSurfaceArea	249.62
Relative PSA	0.31115
PolarSurfaceArea	101.49
Druglikeness	-5.7704
Mutagenic	none
Tumorigenic	high
Reproductive Effective	low
Irritant	high
Nasty Functions
Shape Index	0.65217
Fragments	1
Non HAtoms	23
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	2
BasicNitrogens	2
StereoCon

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