Showing NP-Card for Boron (NP0046184)

  Mrv1652305221920072D          

  1  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 B   0  0  0  0  0  0  0  0  0  0  0  0
M  END

  Mrv1652305221920072D          

  1  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 B   0  0  0  0  0  0  0  0  0  0  0  0
M  END
> <DATABASE_ID>
NP0046184

> <DATABASE_NAME>
NP-MRD

> <SMILES>
B

> <INCHI_IDENTIFIER>
InChI=1S/BH3/h1H3

> <INCHI_KEY>
UORVGPXVDQYIDP-UHFFFAOYSA-N

> <FORMULA>
BH3

> <MOLECULAR_WEIGHT>
13.835

> <EXACT_MASS>
14.032780562

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
2.599173166494826

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
borane

> <JCHEM_LOGP>
0.1220000000000001

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
2.4000000000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
borane

> <JCHEM_VEBER_RULE>
1

$$$$

HEADER    PROTEIN                                 22-MAY-19   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   22-MAY-19         0                                  
HETATM    1  B   UNK     0       0.000   0.000   0.000  0.00  0.00           B+0
MASTER        0    0    0    0    0    0    0    0    1    0    0    0
END