Mrv1572004191602242D          

  3  2  0  0  0  0            999 V2000
    1.2375   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9520   -1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6664   -0.7145    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM008518

> <DATABASE_NAME>
chemdb

> <SMILES>
NC=C

> <INCHI_IDENTIFIER>
InChI=1S/C2H5N/c1-2-3/h2H,1,3H2

> <INCHI_KEY>
UYMKPFRHYYNDTL-UHFFFAOYSA-N

> <FORMULA>
C2H5N

> <MOLECULAR_WEIGHT>
43.069

> <EXACT_MASS>
43.042199165

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
8

> <JCHEM_AVERAGE_POLARIZABILITY>
4.880687411036968

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
ethenamine

> <ALOGPS_LOGP>
-0.37

> <JCHEM_LOGP>
-0.12078446533333335

> <ALOGPS_LOGS>
0.57

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_BASIC>
7.050265898753039

> <JCHEM_POLAR_SURFACE_AREA>
26.02

> <JCHEM_REFRACTIVITY>
13.611

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.60e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
aminoethylene

> <JCHEM_VEBER_RULE>
1

> <NAME>
Ethyleneamine polyphosphates (generic)

> <CAS>
P-09-0248

$$$$