4-(1,3-benzodioxol-5-yl)-2-[(E)-2-(4-chlorophenyl)ethenyl]indeno[1,2-b]pyridin-5-one

Formula:C27H16NO3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-(1,3-benzodioxol-5-yl)-2-[(E)-2-(4-chlorophenyl)ethenyl]indeno[1,2-b]pyridin-5-one is not a drug-like molecule.

MolName	4-(1,3-benzodioxol-5-yl)-2-[(E)-2-(4-chlorophenyl)ethenyl]indeno[1,2-b]pyridin-5-one
MolecularFormula	C27H16NO3Cl
Smiles	O=C(c1c-2cccc1)c1c2nc(/C=C/c(cc2)ccc2Cl)cc1-c(cc1)cc2c1OCO2
InChI	InChI=1S/C27H16ClNO3/c28-18-9-5-16(6-10-18)7-11-19-14-22(17-8-12-23-24(13-17)32-15-31-23)25-26(29-19)20-3-1-2-4-21(20)27(25)30/h1-14H,15H2
InChIK	MPLMBLKYLIHOKS-UHFFFAOYSA-N
TotalMolweight	437.881
Molweight	437.881
MonoisotopicMass	437.081871
CLogP	6.9036
CLogS	-9.306
H Acceptors	4
TotalSurfaceArea	317.73
Relative PSA	0.13851
PolarSurfaceArea	48.42
Druglikeness	-0.51679
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46875
Fragments	1
Non HAtoms	32
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	3
Rings Closures	6
Small Rings	6
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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