(NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine
Molecular Formula : C9H9NO3 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |(NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine is a drug-like molecule.
MolName : (NZ)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydroxylamine |
MolecularFormula : C9H9NO3 |
Smiles : O/N=C\c(cc1)cc2c1OCCO2 |
InChI : InChI=1S/C9H9NO3/c11-10-6-7-1-2-8-9(5-7)13-4-3-12-8/h1-2,5-6,11H,3-4H2 |
InChIK : MQTBKHWWMQAHAF-UHFFFAOYSA-N |
TotalMolweight : 179.174 |
Molweight : 179.174 |
MonoisotopicMass : 179.058244 |
CLogP : 2.1931 |
CLogS : -2.497 |
H Acceptors : 4 |
H Donors : 1 |
TotalSurfaceArea : 138.39 |
Relative PSA : 0.32235 |
PolarSurfaceArea : 51.05 |
Druglikeness : -8.1468 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.69231 |
Fragments : 1 |
Non HAtoms : 13 |
NonCHAtoms : 4 |
Electronegative Atoms : 4 |
Rotatable Bond : 1 |
Rings Closures : 2 |
Small Rings : 2 |
Aromatic Rings : 1 |
Aromatic Atoms : 6 |
Sp3Atoms : 5 |
StereoCon : |