N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-[(2-oxobenzo[cd]indol-1-yl)methyl]benzamide

Formula:C28H21N3O2 Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-[(2-oxobenzo[cd]indol-1-yl)methyl]benzamide is not a drug-like molecule.

MolName	N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-[(2-oxobenzo[cd]indol-1-yl)methyl]benzamide
MolecularFormula	C28H21N3O2
Smiles	O=C(c1ccc(CN(c2c(c3ccc4)c4ccc2)C3=O)cc1)N/N=C(\CC1)/c2c1cccc2
InChI	InChI=1S/C28H21N3O2/c32-27(30-29-24-16-15-19-5-1-2-8-22(19)24)21-13-11-18(12-14-21)17-31-25-10-4-7-20-6-3-9-23(26(20)25)28(31)33/h1-14H,15-17H2,(H,30,32)
InChIK	XRIGALMDBIUDEE-UHFFFAOYSA-N
TotalMolweight	431.494
Molweight	431.494
MonoisotopicMass	431.163377
CLogP	5.6235
CLogS	-7.731
H Acceptors	5
H Donors	1
TotalSurfaceArea	321.89
Relative PSA	0.16341
PolarSurfaceArea	61.77
Druglikeness	4.4613
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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1 - N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-[(2-oxobenzo[cd]indol-1-yl)methyl]benzamide | 2 - N-[(E)-2,3-dihydroinden-1-ylideneamino]-4-[(2-oxobenzo[cd]indol-1-yl)methyl]benzamide

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