4-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]benzoic acid

Formula:C16H13N2O4F Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]benzoic acid is a drug-like molecule.

MolName	4-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]benzoic acid
MolecularFormula	C16H13N2O4F
Smiles	OC(c1ccc(/C=N\NC(COc(cc2)ccc2F)=O)cc1)=O
InChI	InChI=1S/C16H13FN2O4/c17-13-5-7-14(8-6-13)23-10-15(20)19-18-9-11-1-3-12(4-2-11)16(21)22/h1-9H,10H2,(H,19,20)(H,21,22)
InChIK	PNTADEIDEPTZHD-UHFFFAOYSA-N
TotalMolweight	316.287
Molweight	316.287
MonoisotopicMass	316.085936
CLogP	2.3624
CLogS	-3.828
H Acceptors	6
H Donors	2
TotalSurfaceArea	241.2
Relative PSA	0.29913
PolarSurfaceArea	87.99
Druglikeness	2.6797
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.73913
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	4
AcidicOxygens	1
StereoCon

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