N-[(Z)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylideneamino]-N-phenylaniline

Formula:C23H16N3O3Cl Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylideneamino]-N-phenylaniline is not a drug-like molecule.

MolName	N-[(Z)-[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylideneamino]-N-phenylaniline
MolecularFormula	C23H16N3O3Cl
Smiles	[O-][N+](c(cc1)cc(Cl)c1-c1ccc(/C=N\N(c2ccccc2)c2ccccc2)o1)=O
InChI	InChI=1S/C23H16ClN3O3/c24-22-15-19(27(28)29)11-13-21(22)23-14-12-20(30-23)16-25-26(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-16H
InChIK	OEAVPMBCNLOFRV-UHFFFAOYSA-N
TotalMolweight	417.851
Molweight	417.851
MonoisotopicMass	417.088019
CLogP	5.8521
CLogS	-8.382
H Acceptors	6
TotalSurfaceArea	316.38
Relative PSA	0.18835
PolarSurfaceArea	74.56
Druglikeness	0.56962
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro; imine/hydrazone of aldehyde
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	1
Symmetricatoms	8
AcidicOxygens	1
StereoCon

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