Mrv1572004251604322D          

 24 29  0  0  0  0            999 V2000
    5.0422    0.2856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7666    1.0632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4608    0.0585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4965    2.3514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5066   -0.3419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9554    1.2134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3963    0.8810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3056    2.1586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7808   -0.4086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0646    1.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8129   -1.2965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0016   -1.1464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1597   -0.8192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6086    0.7360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5397    1.3675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6954   -0.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4198    0.5859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3485   -0.6690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0362   -0.0532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7261   -0.3687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8305    0.9620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0729    0.1086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0283    0.7692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2617    0.2587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  2  0  0  0  0
  8  4  2  0  0  0  0
  9  3  1  0  0  0  0
 10  4  1  0  0  0  0
 12 11  2  0  0  0  0
 15  7  1  0  0  0  0
 15  8  1  0  0  0  0
 16  5  2  0  0  0  0
 16 13  1  0  0  0  0
 17  6  2  0  0  0  0
 17 14  1  0  0  0  0
 17 16  1  0  0  0  0
 18 11  1  0  0  0  0
 18 13  2  0  0  0  0
 19  9  2  0  0  0  0
 20 12  1  0  0  0  0
 20 19  1  0  0  0  0
 21 10  2  0  0  0  0
 22 14  2  0  0  0  0
 22 18  1  0  0  0  0
 23 15  2  0  0  0  0
 23 19  1  0  0  0  0
 23 21  1  0  0  0  0
 24 20  2  0  0  0  0
 24 21  1  0  0  0  0
 24 22  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM007944

> <DATABASE_NAME>
chemdb

> <SMILES>
C1=CC=C2C=C3C4=C(C=CC3=CC2=C1)C1=CC=CC2=C1C4=CC=C2

> <INCHI_IDENTIFIER>
InChI=1S/C24H14/c1-2-6-17-14-22-18(13-16(17)5-1)11-12-20-19-9-3-7-15-8-4-10-21(23(15)19)24(20)22/h1-14H

> <INCHI_KEY>
ZQYVVUIWXIUAKD-UHFFFAOYSA-N

> <FORMULA>
C24H14

> <MOLECULAR_WEIGHT>
302.376

> <EXACT_MASS>
302.109550451

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
38

> <JCHEM_AVERAGE_POLARIZABILITY>
35.682329154640236

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
hexacyclo[14.7.1.0²,¹⁵.0³,¹².0⁵,¹⁰.0²⁰,²⁴]tetracosa-1(23),2(15),3,5,7,9,11,13,16,18,20(24),21-dodecaene

> <ALOGPS_LOGP>
7.16

> <JCHEM_LOGP>
6.2628809940000005

> <ALOGPS_LOGS>
-8.73

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
99.62299999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
5.67e-07 g/l

> <JCHEM_TRADITIONAL_IUPAC>
hexacyclo[14.7.1.0²,¹⁵.0³,¹².0⁵,¹⁰.0²⁰,²⁴]tetracosa-1(23),2(15),3,5,7,9,11,13,16,18,20(24),21-dodecaene

> <JCHEM_VEBER_RULE>
1

> <NAME>
Naphtho(2,3-j)fluoranthene

> <CAS>
205-83-4

$$$$