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

Formula:C19H19N3O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-[(Z)-[[2-[(2-phenylacetyl)amino]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid is a drug-like molecule.

MolName2-[2-[(Z)-[[2-[(2-phenylacetyl)amino]acetyl]hydrazinylidene]methyl]phenoxy]acetic acid
MolecularFormulaC19H19N3O5
SmilesOC(COc1c(/C=N\NC(CNC(Cc2ccccc2)=O)=O)cccc1)=O
InChIInChI=1S/C19H19N3O5/c23-17(10-14-6-2-1-3-7-14)20-12-18(24)22-21-11-15-8-4-5-9-16(15)27-13-19(25)26/h1-9,11H,10,12-13H2,(H,20,23)(H,22,24)(H,25,26)
InChIKYBOQBFYICSTUHN-UHFFFAOYSA-N
TotalMolweight369.376
Molweight369.376
MonoisotopicMass369.132472
CLogP1.3434
CLogS-3.246
H Acceptors8
H Donors3
TotalSurfaceArea291.58
Relative PSA0.33147
PolarSurfaceArea117.09
Druglikeness5.4242
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond9
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms2
Amides1
AcidicOxygens1
StereoCon

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