N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide

Formula:C25H19N3O6 Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C25H19N3O6
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c(cc1)cc2c1OCO2)N/N=C\c(cc1)cc2c1OCO2
InChI	InChI=1S/C25H19N3O6/c29-24(18-4-2-1-3-5-18)27-19(10-16-6-8-20-22(11-16)33-14-31-20)25(30)28-26-13-17-7-9-21-23(12-17)34-15-32-21/h1-13H,14-15H2,(H,27,29)(H,28,30)
InChIK	QGCZBHATUMZYPQ-UHFFFAOYSA-N
TotalMolweight	457.441
Molweight	457.441
MonoisotopicMass	457.127387
CLogP	5.0411
CLogS	-6.888
H Acceptors	9
H Donors	2
TotalSurfaceArea	341.19
Relative PSA	0.29459
PolarSurfaceArea	107.48
Druglikeness	6.2698
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.47059
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	6
Symmetricatoms	2
Amides	1
StereoCon

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1 - N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide | 2 - N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide

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