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C14H17N3O3 N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2,4-dihydroxybenzamide | Chemryt

N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2,4-dihydroxybenzamide

Molecular Formula : C14H17N3O3 | Mutagenic : high | Tumorigenic : none | Reproductive Effective : |

MolName : N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-2,4-dihydroxybenzamide

MolecularFormula : C14H17N3O3

Smiles : Oc(cc1)cc(O)c1C(N/N=C1/C(CC2)CCN2C1)=O

InChI : InChI=1S/C14H17N3O3/c18-10-1-2-11(13(19)7-10)14(20)16-15-12-8-17-5-3-9(12)4-6-17/h1-2,7,9,18-19H,3-6,8H2,(H,16,20)

InChIK : FJERMFFTEWDWBN-UHFFFAOYSA-N

TotalMolweight : 275.307

Molweight : 275.307

MonoisotopicMass : 275.126992

CLogP : 1.3386

CLogS : -1.88

H Acceptors : 6

H Donors : 3

TotalSurfaceArea : 202.74

Relative PSA : 0.32436

PolarSurfaceArea : 85.16

Druglikeness : 7.7513

Mutagenic : high

Tumorigenic : none

Reproductive Effective : none

Irritant : low

Nasty Functions : acyl-hydrazone

Shape Index : 0.6

Fragments : 1

Non HAtoms : 20

NonCHAtoms : 6

Electronegative Atoms : 6

Rotatable Bond : 2

Rings Closures : 3

Small Rings : 4

Aromatic Rings : 1

Aromatic Atoms : 6

Sp3Atoms : 9

Symmetricatoms : 2

Amines : 1

AlkylAmines : 1

BasicNitrogens : 1

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