2-[(Z)-[[5-[(2Z)-2-[(2-carboxylatophenyl)methylidene]hydrazinyl]-5-oxopentanoyl]hydrazinylidene]methyl]benzoate

Formula:C21H18N4O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(Z)-[[5-[(2Z)-2-[(2-carboxylatophenyl)methylidene]hydrazinyl]-5-oxopentanoyl]hydrazinylidene]methyl]benzoate is a drug-like molecule.

MolName	2-[(Z)-[[5-[(2Z)-2-[(2-carboxylatophenyl)methylidene]hydrazinyl]-5-oxopentanoyl]hydrazinylidene]methyl]benzoate
MolecularFormula	C21H18N4O6
Smiles	[O-]C(c1c(/C=N\NC(CCCC(N/N=C\c(cccc2)c2C([O-])=O)=O)=O)cccc1)=O
InChI	InChI=1S/C21H20N4O6/c26-18(24-22-12-14-6-1-3-8-16(14)20(28)29)10-5-11-19(27)25-23-13-15-7-2-4-9-17(15)21(30)31/h1-4,6-9,12-13H,5,10-11H2,(H,24,26)(H,25,27)(H,28,29)(H,30,31)/p-2
InChIK	KYWOTHLPZRQOGD-UHFFFAOYSA-L
TotalMolweight	422.396
Molweight	422.396
MonoisotopicMass	422.122636
CLogP	-1.2802
CLogS	-4.954
H Acceptors	10
H Donors	2
TotalSurfaceArea	332.8
Relative PSA	0.38059
PolarSurfaceArea	163.18
Druglikeness	-1.2136
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	10
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	15
AcidicOxygens	2
StereoCon

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1 - 2-[(Z)-[[5-[(2Z)-2-[(2-carboxylatophenyl)methylidene]hydrazinyl]-5-oxopentanoyl]hydrazinylidene]methyl]benzoate | 2 - 2-[(Z)-[[5-[(2Z)-2-[(2-carboxylatophenyl)methylidene]hydrazinyl]-5-oxopentanoyl]hydrazinylidene]methyl]benzoate

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