Mrv1572004221603002D          

 11  9  0  0  0  0            999 V2000
   -0.1588   -1.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5557   -1.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8732   -1.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5557   -0.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8732   -0.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1588    0.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1588    0.0917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5557    2.1542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5557    1.3292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5593    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.2083    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  7  4  2  0  0  0  0
  7  5  1  0  0  0  0
  7  6  1  0  0  0  0
  9  6  1  0  0  0  0
  9  8  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM016243

> <DATABASE_NAME>
chemdb

> <SMILES>
Cl.Cl.NNCC1=CC=CC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C7H10N2.2ClH/c8-9-6-7-4-2-1-3-5-7;;/h1-5,9H,6,8H2;2*1H

> <INCHI_KEY>
MSJHOJKVMMEMNX-UHFFFAOYSA-N

> <FORMULA>
C7H12Cl2N2

> <MOLECULAR_WEIGHT>
195.09

> <EXACT_MASS>
194.0377538

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
23

> <JCHEM_AVERAGE_POLARIZABILITY>
13.784297523387247

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
benzylhydrazine dihydrochloride

> <ALOGPS_LOGP>
0.81

> <JCHEM_LOGP>
0.9143588376666669

> <ALOGPS_LOGS>
-0.62

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
5.239947213438028

> <JCHEM_POLAR_SURFACE_AREA>
38.05

> <JCHEM_REFRACTIVITY>
49.508300000000006

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.93e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
benzylhydrazine dihydrochloride

> <JCHEM_VEBER_RULE>
1

> <NAME>
Benzylhydrazine dihydrochloride

> <CAS>
20570-96-1

$$$$