Mrv0541 02241218232D          

  4  3  0  0  0  0            999 V2000
    0.0409    0.6186    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7015   -0.6186    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0409   -0.2064    0.0000 B   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7015   -0.6186    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
M  END
> <DATABASE_ID>
DB11326

> <DATABASE_NAME>
drugbank

> <SMILES>
OB(O)O

> <INCHI_IDENTIFIER>
InChI=1S/BH3O3/c2-1(3)4/h2-4H

> <INCHI_KEY>
KGBXLFKZBHKPEV-UHFFFAOYSA-N

> <FORMULA>
BH3O3

> <MOLECULAR_WEIGHT>
61.833

> <EXACT_MASS>
62.017524428

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
7

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
-0.01963620722185248

> <JCHEM_AVERAGE_POLARIZABILITY>
5.145039272251462

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
boric acid

> <JCHEM_LOGP>
-0.5085999999999995

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.112949480128211

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.698677768419094

> <JCHEM_PKA_STRONGEST_BASIC>
-5.346305507279107

> <JCHEM_POLAR_SURFACE_AREA>
60.69

> <JCHEM_REFRACTIVITY>
7.6937999999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
biotin

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB11326

> <DRUG_GROUPS>
approved

> <GENERIC_NAME>
Boric acid

> <SYNONYMS>
ácido bórico; boracic acid; Boric acid; hydrogen borate; orthoboric acid

> <PRODUCTS>
Acide Borique; Boracic Acid Pwr; Boric Acid; Boric Acid Pwr 100%; Boric Acid Solution 2.5%; British Army Foot Pwr; Collyre Hygienique Soker; Eye Eze; Eye Wash 2.5%; Eyewash; Gynox-soft; Hemorro-dol Sup; ICEKING Skin Expert Anti-onychomycosis Gel; Occu-cal Drops; Occu-cal Lotion; Optrex Eye Drops; Optrex Eye Lotion; Optrex Eye Lotion - Liq Oph; R.O.-eyewash; Recal D; See Clean-One Eye Drops; Sha-lem; Super Septic; Thunas Eye Drops; Trimo San Deodorant Vaginal Jelly; Welders Eye Ease

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