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C9H9NO2 | Cheminformatics

(NZ)-N-(2,3-dihydro-1-benzofuran-5-ylmethylidene)hydroxylamine

Molecular Formula : C9H9NO2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
(NZ)-N-(2,3-dihydro-1-benzofuran-5-ylmethylidene)hydroxylamine is a drug-like molecule.

MolName : (NZ)-N-(2,3-dihydro-1-benzofuran-5-ylmethylidene)hydroxylamine

MolecularFormula : C9H9NO2

Smiles : O/N=C\c(cc1)cc2c1OCC2

InChI : InChI=1S/C9H9NO2/c11-10-6-7-1-2-9-8(5-7)3-4-12-9/h1-2,5-6,11H,3-4H2

InChIK : KZPPLHLNEOMCIV-UHFFFAOYSA-N

TotalMolweight : 163.175

Molweight : 163.175

MonoisotopicMass : 163.063329

CLogP : 2.4401

CLogS : -2.682

H Acceptors : 3

H Donors : 1

TotalSurfaceArea : 128.39

Relative PSA : 0.26957

PolarSurfaceArea : 41.82

Druglikeness : -1.5502

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.66667

Fragments : 1

Non HAtoms : 12

NonCHAtoms : 3

Electronegative Atoms : 3

Rotatable Bond : 1

Rings Closures : 2

Small Rings : 2

Aromatic Rings : 1

Aromatic Atoms : 6

Sp3Atoms : 4

StereoCon :

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