(E)-2-cyano-N-naphthalen-1-yl-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enamide

Formula:C24H15N3O4 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-2-cyano-N-naphthalen-1-yl-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enamide is a drug-like molecule.

MolName	(E)-2-cyano-N-naphthalen-1-yl-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enamide
MolecularFormula	C24H15N3O4
Smiles	N#C/C(/C(Nc1cccc2ccccc12)=O)=C\c1ccc(-c(cccc2)c2[N+]([O-])=O)o1
InChI	InChI=1S/C24H15N3O4/c25-15-17(24(28)26-21-10-5-7-16-6-1-2-8-19(16)21)14-18-12-13-23(31-18)20-9-3-4-11-22(20)27(29)30/h1-14H,(H,26,28)
InChIK	FPZZSWSYMIKUEE-UHFFFAOYSA-N
TotalMolweight	409.4
Molweight	409.4
MonoisotopicMass	409.106257
CLogP	4.2
CLogS	-7.296
H Acceptors	7
H Donors	1
TotalSurfaceArea	316.37
Relative PSA	0.26106
PolarSurfaceArea	111.85
Druglikeness	-5.8032
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB; aromatic nitro
Shape Index	0.51613
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Amides	1
AcidicOxygens	1
StereoCon

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