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C22H18N2O2 | Cheminformatics
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(Z)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1,1-diphenylmethanimine

Molecular Formula : C22H18N2O2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
(Z)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1,1-diphenylmethanimine is not a drug-like molecule.

MolName : (Z)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1,1-diphenylmethanimine

MolecularFormula : C22H18N2O2

Smiles : C1Oc(ccc(/C=N\N=C(c2ccccc2)c2ccccc2)c2)c2OC1

InChI : InChI=1S/C22H18N2O2/c1-3-7-18(8-4-1)22(19-9-5-2-6-10-19)24-23-16-17-11-12-20-21(15-17)26-14-13-25-20/h1-12,15-16H,13-14H2

InChIK : ALLPYOHWSSPEIG-UHFFFAOYSA-N

TotalMolweight : 342.397

Molweight : 342.397

MonoisotopicMass : 342.136828

CLogP : 5.9611

CLogS : -6.09

H Acceptors : 4

TotalSurfaceArea : 274.53

Relative PSA : 0.1567

PolarSurfaceArea : 43.18

Druglikeness : -5.6436

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : dimethylene-hydrazine; imine/hydrazone of aldehyde

Shape Index : 0.53846

Fragments : 1

Non HAtoms : 26

NonCHAtoms : 4

Electronegative Atoms : 4

Rotatable Bond : 4

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 3

Aromatic Atoms : 18

Sp3Atoms : 4

Symmetricatoms : 8

StereoCon :

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1 - (Z)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1,1-diphenylmethanimine
2 - (Z)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-1,1-diphenylmethanimine
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