(E)-3-[5-(3,5-dichlorophenyl)furan-2-yl]-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide

Formula:C25H17NO2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-[5-(3,5-dichlorophenyl)furan-2-yl]-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-[5-(3,5-dichlorophenyl)furan-2-yl]-N-(1,2-dihydroacenaphthylen-5-yl)prop-2-enamide
MolecularFormula	C25H17NO2Cl2
Smiles	O=C(/C=C/c1ccc(-c2cc(Cl)cc(Cl)c2)o1)Nc1ccc(CC2)c3c2cccc13
InChI	InChI=1S/C25H17Cl2NO2/c26-18-12-17(13-19(27)14-18)23-10-7-20(30-23)8-11-24(29)28-22-9-6-16-5-4-15-2-1-3-21(22)25(15)16/h1-3,6-14H,4-5H2,(H,28,29)
InChIK	KYYUFKCXVWGSCP-UHFFFAOYSA-N
TotalMolweight	434.321
Molweight	434.321
MonoisotopicMass	433.063633
CLogP	6.9544
CLogS	-8.588
H Acceptors	3
H Donors	1
TotalSurfaceArea	317.64
Relative PSA	0.12155
PolarSurfaceArea	42.24
Druglikeness	-0.004552
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Symmetricatoms	3
Amides	1
StereoCon

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