(E)-3-naphthalen-1-yl-N-[4-[[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]phenyl]methyl]phenyl]prop-2-enamide

Formula:C39H30N2O2 Mutagenic:low Tumorigenic:high Reproductive Effective:none (E)-3-naphthalen-1-yl-N-[4-[[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]phenyl]methyl]phenyl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-naphthalen-1-yl-N-[4-[[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]phenyl]methyl]phenyl]prop-2-enamide
MolecularFormula	C39H30N2O2
Smiles	O=C(/C=C/c1cccc2ccccc12)Nc1ccc(Cc(cc2)ccc2NC(/C=C/c2cccc3ccccc23)=O)cc1
InChI	InChI=1S/C39H30N2O2/c42-38(25-19-32-11-5-9-30-7-1-3-13-36(30)32)40-34-21-15-28(16-22-34)27-29-17-23-35(24-18-29)41-39(43)26-20-33-12-6-10-31-8-2-4-14-37(31)33/h1-26H,27H2,(H,40,42)(H,41,43)
InChIK	IJEHQVLHDIORDA-UHFFFAOYSA-N
TotalMolweight	558.679
Molweight	558.679
MonoisotopicMass	558.230728
CLogP	8.8177
CLogS	-10.303
H Acceptors	4
H Donors	2
TotalSurfaceArea	446.92
Relative PSA	0.10964
PolarSurfaceArea	58.2
Druglikeness	-0.51946
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.62791
Fragments	1
Non HAtoms	43
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	8
Rings Closures	6
Small Rings	6
Aromatic Rings	6
Aromatic Atoms	32
Sp3Atoms	1
Symmetricatoms	23
Amides	2
StereoCon

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1 - (E)-3-naphthalen-1-yl-N-[4-[[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]phenyl]methyl]phenyl]prop-2-enamide | 2 - (E)-3-naphthalen-1-yl-N-[4-[[4-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]phenyl]methyl]phenyl]prop-2-enamide

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