Mrv1652304272018312D 11 12 0 0 0 0 999 V2000 -2.0625 -2.1435 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 0.4125 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0625 -0.7145 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 0.4125 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -1.4290 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 -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 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -1.4290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 11 1 0 0 0 0 M END > <DATABASE_ID> CDB005551 > <DATABASE_NAME> CDB > <SMILES> CC1=NC2=C(C=C1)N=CC=C2 > <INCHI_IDENTIFIER> InChI=1S/C9H8N2/c1-7-4-5-8-9(11-7)3-2-6-10-8/h2-6H,1H3 > <INCHI_KEY> KIWHWEDXEGNASX-UHFFFAOYSA-N > <FORMULA> C9H8N2 > <MOLECULAR_WEIGHT> 144.177 > <EXACT_MASS> 144.068748266 > <JCHEM_ACCEPTOR_COUNT> 2 > <JCHEM_ATOM_COUNT> 19 > <JCHEM_AVERAGE_POLARIZABILITY> 15.580904171373186 > <JCHEM_BIOAVAILABILITY> 1 > <JCHEM_DONOR_COUNT> 0 > <JCHEM_FORMAL_CHARGE> 0 > <JCHEM_GHOSE_FILTER> 0 > <JCHEM_IUPAC> 2-methyl-1,5-naphthyridine > <ALOGPS_LOGP> 1.69 > <JCHEM_LOGP> 1.4304485389999997 > <ALOGPS_LOGS> -1.82 > <JCHEM_MDDR_LIKE_RULE> 0 > <JCHEM_NUMBER_OF_RINGS> 2 > <JCHEM_PHYSIOLOGICAL_CHARGE> 0 > <JCHEM_PKA_STRONGEST_BASIC> 2.506087770971364 > <JCHEM_POLAR_SURFACE_AREA> 25.78 > <JCHEM_REFRACTIVITY> 42.0419 > <JCHEM_ROTATABLE_BOND_COUNT> 0 > <JCHEM_RULE_OF_FIVE> 1 > <ALOGPS_SOLUBILITY> 2.17e+00 g/l > <JCHEM_TRADITIONAL_IUPAC> 2-methyl-1,5-naphthyridine > <JCHEM_VEBER_RULE> 1 > <Cannabis Database ID> CDB005551 > <GENERIC_NAME> 2-Methyl-1,5-naphthyridine $$$$