Mrv0541 02231217232D          

  3  2  0  0  0  0            999 V2000
    1.2375   -0.7145    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.9520   -1.1270    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.6664   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
M  CHG  1   1  -1
M  END
> <DATABASE_ID>
DB04053

> <DATABASE_NAME>
drugbank

> <SMILES>
[O-]P=O

> <INCHI_IDENTIFIER>
InChI=1S/HO2P/c1-3-2/h(H,1,2)/p-1

> <INCHI_KEY>
GQZXNSPRSGFJLY-UHFFFAOYSA-M

> <FORMULA>
O2P

> <MOLECULAR_WEIGHT>
62.9726

> <EXACT_MASS>
62.963590756

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
3

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
-0.9999999999914333

> <JCHEM_AVERAGE_POLARIZABILITY>
3.239918504674499

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
-1

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
oxophosphinite

> <JCHEM_LOGP>
-0.5875999999999999

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
-1

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
-4.067187441773434

> <JCHEM_POLAR_SURFACE_AREA>
40.129999999999995

> <JCHEM_REFRACTIVITY>
8.0858

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
biotin

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB04053

> <SECONDARY_ACCESSION_NUMBERS>
EXPT02627

> <DRUG_GROUPS>
experimental

> <GENERIC_NAME>
Hypophosphite

> <SYNONYMS>
Hypophosphite ion

$$$$