2-[2-[(Z)-[[2-[(2-phenoxyacetyl)amino]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid

Formula:C19H19N3O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-[(Z)-[[2-[(2-phenoxyacetyl)amino]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid is a drug-like molecule.

MolName2-[2-[(Z)-[[2-[(2-phenoxyacetyl)amino]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid
MolecularFormulaC19H19N3O6
SmilesOC(COc1c(/C=N\NC(CNC(COc2ccccc2)=O)=O)cccc1)=O
InChIInChI=1S/C19H19N3O6/c23-17(11-20-18(24)12-27-15-7-2-1-3-8-15)22-21-10-14-6-4-5-9-16(14)28-13-19(25)26/h1-10H,11-13H2,(H,20,24)(H,22,23)(H,25,26)
InChIKIFZWCFULVVEBGB-UHFFFAOYSA-N
TotalMolweight385.375
Molweight385.375
MonoisotopicMass385.127387
CLogP0.9202
CLogS-3.061
H Acceptors9
H Donors3
TotalSurfaceArea301.58
Relative PSA0.35364
PolarSurfaceArea126.32
Druglikeness5.2568
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.67857
Fragments1
Non HAtoms28
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond10
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms6
Symmetricatoms2
Amides1
AcidicOxygens1
StereoCon

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