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Quinolones

PubChem CID: 6038

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Compound Synonyms 2-Hydroxyquinoline, 59-31-4, 2-Quinolinol, Quinolin-2-ol, Carbostyril, Quinolin-2(1H)-one, 2(1H)-Quinolinone, 2-Quinolone, 1H-quinolin-2-one, Quinolinol, quinolone, Quinolinone, 70254-42-1, alpha-Quinolone, o-Aminocinnamic acid lactam, 1321-40-0, 2(1H)-Quinolone, 2-Quinolinone, 104534-80-7, Quinolones, 2-OXOQUINOLINE, MFCD00006743, 1,2-dihydroquinolin-2-one, .alpha.-Quinolone, NSC 156783, .alpha.-Hydroxyquinoline, 803BHY7QWU, CHEMBL186422, CHEBI:16365, NSC-156783, 2-(1H)-QUINOLINONE, alpha-Hydroxyquinoline, Ketoquinoline, Ketoquinolines, Oxoquinolines, Quinolinones, Hydroxyquinoleine, Hydroxyquinoleine [French], hydroquinolin-2-one, Carbostyril (VAN), CCRIS 4327, EINECS 200-420-6, UNII-803BHY7QWU, hyroxyquinoline, hydroquinolinone, AI3-00782, 1H-quinolinone, quino- lone, 1H-quinolone, 2-Chinolinol, quinolin-2-one, a-Hydroxyquinoline, 3srg, 1-H-quinolone, EINECS 274-516-1, 2-[1h]-quinolone, quinoline, 2-hydroxy-, starbld0000627, 2-HYDROXYQUINOLINE (2-QUINOLINOL), CARBOSTYRIL [MI], 2-Hydroxyquinoline, 98%, SCHEMBL8621, 2-oxo-1,2-dihydroquinoline, HYDROXYQUINOLINE, 2-, MLS004491723, NSC554, DTXSID1058769, CHEBI:18289, CHEBI:23765, DTXSID60879991, NSC-554, HMS3604N04, STR05548, BDBM50366034, MFCD00463096, NSC156783, STK097666, STK414900, AKOS003297745, AKOS015897112, AC-3056, CS-W005598, DB04745, FH40553, GS-6597, PS-4021, SB37816, SB67445, NCGC00166019-01, BP-10114, SMR003288680, SY003693, SY303522, DB-021213, DB-228250, H0304, NS00034131, EN300-67221, C06338, C06415, E82978, 10.14272/LISFMEBWQUVKPJ-UHFFFAOYSA-N.1, AC-907/25014359, doi:10.14272/LISFMEBWQUVKPJ-UHFFFAOYSA-N.1, Q27095480, Z57473020, F0001-1542, InChI=1/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11
Topological Polar Surface Area 29.1
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 11.0
Isotope Atom Count 0.0
Molecular Complexity 198.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P51450, O97447, P22894, P29477, P08253, P14780, P15917, P08254, O42713, P09917, P03956, Q9UBT6, P00918, P00915, Q9Y2D0, P07451, P43166, P35218, P22748, O43570, Q16790, Q8N1Q1, Q9ULX7, P23280, Q9H2K2, P14598, P0DTD1, n.a.
Iupac Name 1H-quinolin-2-one
Prediction Hob 1.0
Target Id NPT947, NPT1144, NPT1146, NPT955, NPT1143, NPT1062, NPT949, NPT948, NPT3101, NPT954, NPT1063
Xlogp 1.3
Molecular Formula C9H7NO
Prediction Swissadme 0.0
Inchi Key LISFMEBWQUVKPJ-UHFFFAOYSA-N
Fcsp3 0.0
Logs -5.287
Rotatable Bond Count 0.0
Logd 4.542
Compound Name Quinolones
Prediction Hob Swissadme 0.0
Exact Mass 145.053
Formal Charge 0.0
Monoisotopic Mass 145.053
Hydrogen Bond Acceptor Count 1.0
Molecular Weight 145.16
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -2.798725472727273
Inchi InChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11)
Smiles C1=CC=C2C(=C1)C=CC(=O)N2
Nring 2.0
Defined Bond Stereocenter Count 0.0