(E)-1-[5-(2,3-dichlorophenyl)furan-2-yl]-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-en-1-one

Formula:C23H13NO5Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-1-[5-(2,3-dichlorophenyl)furan-2-yl]-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-en-1-one is not a drug-like molecule.

MolName	(E)-1-[5-(2,3-dichlorophenyl)furan-2-yl]-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-en-1-one
MolecularFormula	C23H13NO5Cl2
Smiles	[O-][N+](c1cccc(-c2ccc(/C=C/C(c3ccc(-c4cccc(Cl)c4Cl)o3)=O)o2)c1)=O
InChI	InChI=1S/C23H13Cl2NO5/c24-18-6-2-5-17(23(18)25)21-11-12-22(31-21)19(27)9-7-16-8-10-20(30-16)14-3-1-4-15(13-14)26(28)29/h1-13H
InChIK	AJOVMFFVKIBLHY-UHFFFAOYSA-N
TotalMolweight	454.264
Molweight	454.264
MonoisotopicMass	453.017078
CLogP	5.472
CLogS	-8.692
H Acceptors	6
TotalSurfaceArea	330.68
Relative PSA	0.21677
PolarSurfaceArea	89.17
Druglikeness	-2.9337
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	1
AcidicOxygens	1
StereoCon

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