Mrv1652304272018512D          

 18 20  0  0  0  0            999 V2000
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3913   -2.4614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1450   -2.1259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7239   -1.9766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2312   -1.3054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8101   -1.1561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3175    1.1561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5638   -0.8205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4570   -0.1715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6500    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8695    0.5430    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5638    0.8205    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7925   -0.9252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 12  2  0  0  0  0
  8 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 13  1  0  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 12 15  1  0  0  0  0
 13 15  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 14 18  1  0  0  0  0
 15 17  1  0  0  0  0
M  END
> <DATABASE_ID>
CDB005740

> <DATABASE_NAME>
CDB

> <SMILES>
OC1=NCNC1(C1=CC=CC=C1)C1=CC=CC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C15H14N2O/c18-14-15(17-11-16-14,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,17H,11H2,(H,16,18)

> <INCHI_KEY>
FEJIIZAOQRTGPC-UHFFFAOYSA-N

> <FORMULA>
C15H14N2O

> <MOLECULAR_WEIGHT>
238.29

> <EXACT_MASS>
238.110613079

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
32

> <JCHEM_AVERAGE_POLARIZABILITY>
25.249218619319894

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
5,5-diphenyl-2,5-dihydro-1H-imidazol-4-ol

> <ALOGPS_LOGP>
1.90

> <JCHEM_LOGP>
2.6904853598545406

> <ALOGPS_LOGS>
-3.09

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
4.022482642977556

> <JCHEM_PKA_STRONGEST_BASIC>
2.2503161848483897

> <JCHEM_POLAR_SURFACE_AREA>
44.620000000000005

> <JCHEM_REFRACTIVITY>
69.9953

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.93e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5,5-diphenyl-1,2-dihydroimidazol-4-ol

> <JCHEM_VEBER_RULE>
0

> <Cannabis Database ID>
CDB005740

> <GENERIC_NAME>
5,5-Diphenylimidazolid-4-one

$$$$