Mrv1652301121721402D          

  4  2  0  0  0  0            999 V2000
   -0.7145    0.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.2750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.1375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7180    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
M  END
> <DATABASE_ID>
DBSALT002005

> <DATABASE_NAME>
drugbank

> <SMILES>
Cl.CON

> <INCHI_IDENTIFIER>
InChI=1S/CH5NO.ClH/c1-3-2;/h2H2,1H3;1H

> <INCHI_KEY>
XNXVOSBNFZWHBV-UHFFFAOYSA-N

> <FORMULA>
CH6ClNO

> <MOLECULAR_WEIGHT>
83.52

> <EXACT_MASS>
83.0137915

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
10

> <JCHEM_AVERAGE_POLARIZABILITY>
4.702378524686882

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
O-methylhydroxylamine hydrochloride

> <ALOGPS_LOGP>
-0.76

> <JCHEM_LOGP>
-0.36253565700000007

> <ALOGPS_LOGS>
1.11

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
4.321035657011591

> <JCHEM_POLAR_SURFACE_AREA>
35.25

> <JCHEM_REFRACTIVITY>
12.331

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
6.00e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
O-methylhydroxylamine hydrochloride

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DBSALT002005

> <NAME>
Methoxyamine hydrochloride

> <DRUG_DRUGBANK_ID>
DB06328

> <DRUG_NAME>
Methoxyamine

> <CAS_NUMBER>
593-56-6

> <UNII>
203546OLMF

$$$$