2-[4-[(Z)-[[2-(1,3-benzodioxol-5-yloxy)acetyl]hydrazinylidene]methyl]-3-phenylpyrazol-1-yl]acetamide

Formula:C21H19N5O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[4-[(Z)-[[2-(1,3-benzodioxol-5-yloxy)acetyl]hydrazinylidene]methyl]-3-phenylpyrazol-1-yl]acetamide is a drug-like molecule.

MolName	2-[4-[(Z)-[[2-(1,3-benzodioxol-5-yloxy)acetyl]hydrazinylidene]methyl]-3-phenylpyrazol-1-yl]acetamide
MolecularFormula	C21H19N5O5
Smiles	NC(Cn(cc1/C=N\NC(COc(cc2)cc3c2OCO3)=O)nc1-c1ccccc1)=O
InChI	InChI=1S/C21H19N5O5/c22-19(27)11-26-10-15(21(25-26)14-4-2-1-3-5-14)9-23-24-20(28)12-29-16-6-7-17-18(8-16)31-13-30-17/h1-10H,11-13H2,(H2,22,27)(H,24,28)
InChIK	FLHWLGRSIQKKBT-UHFFFAOYSA-N
TotalMolweight	421.412
Molweight	421.412
MonoisotopicMass	421.13862
CLogP	1.2823
CLogS	-4.313
H Acceptors	10
H Donors	2
TotalSurfaceArea	318.76
Relative PSA	0.35186
PolarSurfaceArea	130.06
Druglikeness	7.1862
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.54839
Fragments	1
Non HAtoms	31
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	6
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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