2,4-difluoro-N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]aniline

Formula:C15H11N3O2F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2,4-difluoro-N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]aniline is a drug-like molecule.

MolName	2,4-difluoro-N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]aniline
MolecularFormula	C15H11N3O2F2
Smiles	[O-][N+](c1c(/C=C/C=N\Nc(ccc(F)c2)c2F)cccc1)=O
InChI	InChI=1S/C15H11F2N3O2/c16-12-7-8-14(13(17)10-12)19-18-9-3-5-11-4-1-2-6-15(11)20(21)22/h1-10,19H
InChIK	QDDAWRBDQWBXMO-UHFFFAOYSA-N
TotalMolweight	303.267
Molweight	303.267
MonoisotopicMass	303.081933
CLogP	4.1392
CLogS	-4.529
H Acceptors	5
H Donors	1
TotalSurfaceArea	232.11
Relative PSA	0.23002
PolarSurfaceArea	70.21
Druglikeness	-4.425
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; imine/hydrazone of aldehyde
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
AcidicOxygens	1
StereoCon

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