2-[2-[(Z)-[[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]hydrazinylidene]methyl]phenoxy]acetate

Formula:C17H13N4O5 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[2-[(Z)-[[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]hydrazinylidene]methyl]phenoxy]acetate is a drug-like molecule.

MolName	2-[2-[(Z)-[[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]hydrazinylidene]methyl]phenoxy]acetate
MolecularFormula	C17H13N4O5
Smiles	[O-]C(COc1c(/C=N\NC(c2n[nH]c(-c3ccco3)c2)=O)cccc1)=O
InChI	InChI=1S/C17H14N4O5/c22-16(23)10-26-14-5-2-1-4-11(14)9-18-21-17(24)13-8-12(19-20-13)15-6-3-7-25-15/h1-9H,10H2,(H,19,20)(H,21,24)(H,22,23)/p-1
InChIK	AKSBEWFATRFKPJ-UHFFFAOYSA-M
TotalMolweight	353.313
Molweight	353.313
MonoisotopicMass	353.088596
CLogP	-0.8909
CLogS	-3.239
H Acceptors	9
H Donors	2
TotalSurfaceArea	273.81
Relative PSA	0.4105
PolarSurfaceArea	132.64
Druglikeness	5.763
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	3
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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