(E)-4-[2-(3-hydroxynaphthalene-2-carbonyl)hydrazinyl]-4-oxobut-2-enoic acid

Formula:C15H12N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-4-[2-(3-hydroxynaphthalene-2-carbonyl)hydrazinyl]-4-oxobut-2-enoic acid is a drug-like molecule.

MolName	(E)-4-[2-(3-hydroxynaphthalene-2-carbonyl)hydrazinyl]-4-oxobut-2-enoic acid
MolecularFormula	C15H12N2O5
Smiles	OC(/C=C/C(NNC(c1cc2ccccc2cc1O)=O)=O)=O
InChI	InChI=1S/C15H12N2O5/c18-12-8-10-4-2-1-3-9(10)7-11(12)15(22)17-16-13(19)5-6-14(20)21/h1-8,18H,(H,16,19)(H,17,22)(H,20,21)
InChIK	NWBTVQKEBZUVHD-UHFFFAOYSA-N
TotalMolweight	300.269
Molweight	300.269
MonoisotopicMass	300.074623
CLogP	0.4028
CLogS	-3.237
H Acceptors	7
H Donors	4
TotalSurfaceArea	223.23
Relative PSA	0.39529
PolarSurfaceArea	115.73
Druglikeness	2.023
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	2
AcidicOxygens	1
StereoCon

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