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C16H17NO2 (2Z)-2-(1-benzofuran-2-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-ol | Chemryt

(2Z)-2-(1-benzofuran-2-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-ol

Molecular Formula : C16H17NO2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : |

MolName : (2Z)-2-(1-benzofuran-2-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-ol

MolecularFormula : C16H17NO2

Smiles : OC(C1CCN2CC1)/C2=C/c1cc(cccc2)c2o1

InChI : InChI=1S/C16H17NO2/c18-16-11-5-7-17(8-6-11)14(16)10-13-9-12-3-1-2-4-15(12)19-13/h1-4,9-11,16,18H,5-8H2/t16-/m0/s1

InChIK : OEZRTOHMPGWJNS-INIZCTEOSA-N

TotalMolweight : 255.316

Molweight : 255.316

MonoisotopicMass : 255.125929

CLogP : 2.7672

CLogS : -3.801

H Acceptors : 3

H Donors : 1

TotalSurfaceArea : 191.95

Relative PSA : 0.16025

PolarSurfaceArea : 36.61

Druglikeness : 4.945

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Shape Index : 0.52632

Fragments : 1

Non HAtoms : 19

NonCHAtoms : 3

Electronegative Atoms : 3

StereoCenters : 1

Rotatable Bond : 1

Rings Closures : 4

Small Rings : 5

Aromatic Rings : 2

Aromatic Atoms : 9

Sp3Atoms : 8

Symmetricatoms : 2

BasicNitrogens : 1

StereoCon : racemate

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