(E)-N-(9H-fluoren-2-yl)-3-(4-nitrophenyl)prop-2-en-1-imine

Formula:C22H16N2O2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-N-(9H-fluoren-2-yl)-3-(4-nitrophenyl)prop-2-en-1-imine is a drug-like molecule.

MolName	(E)-N-(9H-fluoren-2-yl)-3-(4-nitrophenyl)prop-2-en-1-imine
MolecularFormula	C22H16N2O2
Smiles	[O-][N+](c1ccc(/C=C/C=N/c(cc2)cc(C3)c2-c2c3cccc2)cc1)=O
InChI	InChI=1S/C22H16N2O2/c25-24(26)20-10-7-16(8-11-20)4-3-13-23-19-9-12-22-18(15-19)14-17-5-1-2-6-21(17)22/h1-13,15H,14H2
InChIK	HAOLKLICEFOBQW-UHFFFAOYSA-N
TotalMolweight	340.381
Molweight	340.381
MonoisotopicMass	340.121178
CLogP	4.1484
CLogS	-6.621
H Acceptors	4
TotalSurfaceArea	267.97
Relative PSA	0.15647
PolarSurfaceArea	58.18
Druglikeness	-5.5035
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; imine/hydrazone of aldehyde
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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