(E)-2-cyano-3-[2-[(2-cyanophenyl)methoxy]naphthalen-1-yl]-N-(4-hydroxyphenyl)prop-2-enamide

Formula:C28H19N3O3 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-2-cyano-3-[2-[(2-cyanophenyl)methoxy]naphthalen-1-yl]-N-(4-hydroxyphenyl)prop-2-enamide is not a drug-like molecule.

MolName	(E)-2-cyano-3-[2-[(2-cyanophenyl)methoxy]naphthalen-1-yl]-N-(4-hydroxyphenyl)prop-2-enamide
MolecularFormula	C28H19N3O3
Smiles	N#C/C(/C(Nc(cc1)ccc1O)=O)=C\c(c1ccccc1cc1)c1OCc(cccc1)c1C#N
InChI	InChI=1S/C28H19N3O3/c29-16-20-6-1-2-7-21(20)18-34-27-14-9-19-5-3-4-8-25(19)26(27)15-22(17-30)28(33)31-23-10-12-24(32)13-11-23/h1-15,32H,18H2,(H,31,33)
InChIK	GGANYLKMWRYSNF-UHFFFAOYSA-N
TotalMolweight	445.477
Molweight	445.477
MonoisotopicMass	445.142642
CLogP	5.0207
CLogS	-7.194
H Acceptors	6
H Donors	2
TotalSurfaceArea	354.83
Relative PSA	0.21058
PolarSurfaceArea	106.14
Druglikeness	-1.9574
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.5
Fragments	1
Non HAtoms	34
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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