(3E)-3-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid

Formula:C24H15NO3Cl2 Mutagenic:low Tumorigenic:high Reproductive Effective:none (3E)-3-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid is not a drug-like molecule.

MolName	(3E)-3-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid
MolecularFormula	C24H15NO3Cl2
Smiles	OC(c1c(CC/C2=C\c3ccc(-c4cccc(Cl)c4Cl)o3)c2nc2ccccc12)=O
InChI	InChI=1S/C24H15Cl2NO3/c25-18-6-3-5-16(22(18)26)20-11-9-14(30-20)12-13-8-10-17-21(24(28)29)15-4-1-2-7-19(15)27-23(13)17/h1-7,9,11-12H,8,10H2,(H,28,29)
InChIK	AGIRCECDWROUSO-UHFFFAOYSA-N
TotalMolweight	436.293
Molweight	436.293
MonoisotopicMass	435.042898
CLogP	5.9772
CLogS	-7.475
H Acceptors	4
H Donors	1
TotalSurfaceArea	309.5
Relative PSA	0.16549
PolarSurfaceArea	63.33
Druglikeness	0.17933
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	30
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	3
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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1 - (3E)-3-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid | 2 - (3E)-3-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid

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