
 CHEMBL95384

 30 32  0  0  0  0  0  0  0  0999 V2000
    0.9814   -0.2414    0.0878 C   0  0  0  0  0
    2.4695   -0.0553    0.1057 C   0  0  0  0  0
    3.2348   -1.1762    0.0821 N   0  0  0  0  0
    4.5770   -1.0223    0.0999 C   0  0  0  0  0
    5.1847    0.2312    0.1407 C   0  0  0  0  0
    4.3928    1.3756    0.1650 C   0  0  0  0  0
    3.0097    1.2288    0.1478 C   0  0  0  0  0
    6.6600    0.3040    0.1636 C   0  0  0  0  0
    7.2471    1.3800    0.1824 O   0  0  0  0  0
    7.4191   -0.9714    0.1597 C   0  0  0  0  0
    6.7375   -2.1285    0.1181 C   0  0  0  0  0
    5.3661   -2.1700    0.0664 N   0  0  0  0  0
    7.4601   -3.4159    0.0900 C   0  0  0  0  0
    7.1696   -4.3611   -0.9071 C   0  0  0  0  0
    7.8374   -5.5895   -0.9430 C   0  0  0  0  0
    8.8026   -5.8910    0.0172 C   0  0  0  0  0
    9.1010   -4.9643    1.0138 C   0  0  0  0  0
    8.4327   -3.7415    1.0452 C   0  0  0  0  0
    8.7391   -2.8775    2.0254 F   0  0  0  0  0
    0.5476    0.2609   -0.7824 H   0  0  0  0  0
    0.5384    0.1704    0.9999 H   0  0  0  0  0
    0.7223   -1.3038    0.0318 H   0  0  0  0  0
    4.8467    2.3620    0.1987 H   0  0  0  0  0
    2.3662    2.1036    0.1670 H   0  0  0  0  0
    8.4988   -0.8975    0.1872 H   0  0  0  0  0
    4.8656   -3.0475    0.0895 H   0  0  0  0  0
    6.4286   -4.1417   -1.6736 H   0  0  0  0  0
    7.6050   -6.3102   -1.7240 H   0  0  0  0  0
    9.3215   -6.8461   -0.0119 H   0  0  0  0  0
    9.8486   -5.1845    1.7696 H   0  0  0  0  0
  1  2  1  0  0  0
  1 20  1  0  0  0
  1 21  1  0  0  0
  1 22  1  0  0  0
  2  7  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  4  5  2  0  0  0
  4 12  1  0  0  0
  5  8  1  0  0  0
  5  6  1  0  0  0
  6  7  2  0  0  0
  6 23  1  0  0  0
  7 24  1  0  0  0
  8 10  1  0  0  0
  8  9  2  0  0  0
 10 11  2  0  0  0
 10 25  1  0  0  0
 11 12  1  0  0  0
 11 13  1  0  0  0
 12 26  1  0  0  0
 13 14  2  0  0  0
 13 18  1  0  0  0
 14 15  1  0  0  0
 14 27  1  0  0  0
 15 16  2  0  0  0
 15 28  1  0  0  0
 16 17  1  0  0  0
 16 29  1  0  0  0
 17 18  2  0  0  0
 17 30  1  0  0  0
 18 19  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL95384

>  <PubChem CID>
10538858

>  <Formula>
C15H11FN2O

>  <Molecular Weight>
254.264000

>  <IUPAC Name>
2-(2-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one

>  <XlogP>
3.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1=NC2=C(C=C1)C(=O)C=C(N2)C3=CC=CC=C3F

>  <Isomeric SMILES>
CC1=NC2=C(C=C1)C(=O)C=C(N2)C3=CC=CC=C3F

>  <InChI Std. ID>
InChI=1S/C15H11FN2O/c1-9-6-7-11-14(19)8-13(18-15(11)17-9)10-4-2-3-5-12(10)16/h2-8H,1H3,(H,17,18,19)

>  <InChI Key>
AXHXSGOIYWBQTM-UHFFFAOYSA-N

