N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-1,3-benzodioxole-5-carboxamide

Formula:C18H16N2O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-1,3-benzodioxole-5-carboxamide is a drug-like molecule.

MolName	N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-1,3-benzodioxole-5-carboxamide
MolecularFormula	C18H16N2O3
Smiles	O=C(c(cc1)cc2c1OCO2)N/N=C(\CCC1)/c2c1cccc2
InChI	InChI=1S/C18H16N2O3/c21-18(13-8-9-16-17(10-13)23-11-22-16)20-19-15-7-3-5-12-4-1-2-6-14(12)15/h1-2,4,6,8-10H,3,5,7,11H2,(H,20,21)
InChIK	CNRNZUISEHUUGL-UHFFFAOYSA-N
TotalMolweight	308.336
Molweight	308.336
MonoisotopicMass	308.116093
CLogP	3.9857
CLogS	-5.381
H Acceptors	5
H Donors	1
TotalSurfaceArea	233.24
Relative PSA	0.24014
PolarSurfaceArea	59.92
Druglikeness	0.3465
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	2
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
StereoCon

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