
 CHEMBL238344

 37 39  0  0  0  0  0  0  0  0999 V2000
    6.6236    3.6587    2.1082 C   0  0  0  0  0
    5.9793    2.4428    1.5135 C   0  0  0  0  0
    6.7308    1.3166    1.4588 N   0  0  0  0  0
    6.2031    0.2093    0.9075 C   0  0  0  0  0
    6.9616   -0.9451    0.8489 C   0  0  0  0  0
    6.4443   -2.1059    0.2793 C   0  0  0  0  0
    5.1827   -2.1471   -0.2163 N   0  0  0  0  0
    4.4505   -1.0136   -0.1572 C   0  0  0  0  0
    4.9049    0.1843    0.3865 C   0  0  0  0  0
    4.1399    1.3596    0.4414 C   0  0  0  0  0
    4.6874    2.5053    1.0080 C   0  0  0  0  0
    7.2204   -3.3620    0.1815 C   0  0  0  0  0
    8.6225   -3.3594    0.0661 C   0  0  0  0  0
    9.3551   -4.5454   -0.0274 C   0  0  0  0  0
    8.6896   -5.7665    0.0122 C   0  0  0  0  0
    7.2974   -5.8083    0.1215 C   0  0  0  0  0
    6.5742   -4.6144    0.1986 C   0  0  0  0  0
    6.7696   -7.0716    0.1481 O   0  0  0  0  0
    5.3559   -7.1772    0.2631 C   0  0  0  0  0
   10.7110   -4.3804   -0.1124 O   0  0  0  0  0
   11.4271   -5.4391   -0.7376 C   0  0  0  0  0
    5.9164    4.2022    2.7426 H   0  0  0  0  0
    6.9752    4.3213    1.3119 H   0  0  0  0  0
    7.4806    3.3759    2.7285 H   0  0  0  0  0
    7.9617   -0.9230    1.2691 H   0  0  0  0  0
    3.4499   -1.1007   -0.5773 H   0  0  0  0  0
    3.1283    1.3856    0.0456 H   0  0  0  0  0
    4.1138    3.4256    1.0547 H   0  0  0  0  0
    9.1728   -2.4218    0.0221 H   0  0  0  0  0
    9.2276   -6.7078   -0.0232 H   0  0  0  0  0
    5.4909   -4.6264    0.2839 H   0  0  0  0  0
    5.0993   -8.2410    0.2479 H   0  0  0  0  0
    4.8526   -6.7026   -0.5855 H   0  0  0  0  0
    5.0064   -6.7638    1.2148 H   0  0  0  0  0
   12.4735   -5.1284   -0.8185 H   0  0  0  0  0
   11.0512   -5.6203   -1.7503 H   0  0  0  0  0
   11.4031   -6.3529   -0.1368 H   0  0  0  0  0
  1  2  1  0  0  0
  1 22  1  0  0  0
  1 23  1  0  0  0
  1 24  1  0  0  0
  2 11  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  4  9  1  0  0  0
  4  5  2  0  0  0
  5  6  1  0  0  0
  5 25  1  0  0  0
  6  7  2  0  0  0
  6 12  1  0  0  0
  7  8  1  0  0  0
  8  9  2  0  0  0
  8 26  1  0  0  0
  9 10  1  0  0  0
 10 11  2  0  0  0
 10 27  1  0  0  0
 11 28  1  0  0  0
 12 17  1  0  0  0
 12 13  2  0  0  0
 13 14  1  0  0  0
 13 29  1  0  0  0
 14 15  2  0  0  0
 14 20  1  0  0  0
 15 16  1  0  0  0
 15 30  1  0  0  0
 16 17  2  0  0  0
 16 18  1  0  0  0
 17 31  1  0  0  0
 18 19  1  0  0  0
 19 32  1  0  0  0
 19 33  1  0  0  0
 19 34  1  0  0  0
 20 21  1  0  0  0
 21 35  1  0  0  0
 21 36  1  0  0  0
 21 37  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL238344

>  <PubChem CID>
44434752

>  <Formula>
C17H16N2O2

>  <Molecular Weight>
280.327000

>  <IUPAC Name>
7-(3,5-dimethoxyphenyl)-2-methyl-1,6-naphthyridine

>  <XlogP>
3.1

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1=NC2=CC(=NC=C2C=C1)C3=CC(=CC(=C3)OC)OC

>  <Isomeric SMILES>
CC1=NC2=CC(=NC=C2C=C1)C3=CC(=CC(=C3)OC)OC

>  <InChI Std. ID>
InChI=1S/C17H16N2O2/c1-11-4-5-12-10-18-16(9-17(12)19-11)13-6-14(20-2)8-15(7-13)21-3/h4-10H,1-3H3

>  <InChI Key>
AWGMVVADCJSVIO-UHFFFAOYSA-N

