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4-Aminosalicylic acid

PubChem CID: 4649

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Compound Synonyms 4-Aminosalicylic acid, 4-Amino-2-hydroxybenzoic acid, 65-49-6, Aminosalicylic acid, P-AMINOSALICYLIC ACID, Rezipas, Paramycin, Pamisyl, Parasal, Paser, Para-aminosalicylic acid, Parasalindon, Aminopar, Deapasil, Apacil, Benzoic acid, 4-amino-2-hydroxy-, Gabbropas, Parasalicil, Pasnodia, Aminox, Entepas, Osacyl, Pamacyl, Pasalon, Pasara, Pasdium, Pasmed, Pasolac, Propasa, Pasem, Pasa, 2-Hydroxy-4-aminobenzoic acid, APAS, PASK, Para-Pas, Sanipirol-4, para-Amino salicylic acid, Hellipidyl, Pascorbic, PAS-C, PAS (acid), PAS, Kyselina p-aminosalicylova, aminosalicylate, Salicylic acid, 4-amino-, 3-Hydroxy-4-carboxyaniline, Amino-pas, Sanipriol-4, 4-Aminosalicylate, MFCD00007789, NIH 2939, NSC 2083, 4-Asa, AMINOSALICYLATE SODIUM, Aminosalicylic Acid [USP], A 1909, 4-amino-2-hydroxy-benzoic acid, p-amino salicylic acid, NSC-2083, MLS000069418, CHEBI:27565, NSC2083, 5B2658E0N2, Aminosalyl, Helipidyl, SMR000059110, Paser Granules, Aminosalicylic acid (USP), MLS000069579, PAS (VAN), 4-Aminosalicylicacid, Benzoic acid, 4-aminohydroxy-, HSDB 3203, 4-amino salicylic acid, Kyselina p-aminosalicylova [Czech], SR-01000002990, SMR000058830, EINECS 200-613-5, BRN 0473071, P.A.S, Aminosalicylic, Granupas, AI3-50142, UNII-5B2658E0N2, ISONICOTINIC ACID HYDRAZIDE P-AMINOSALICYLATE SALT, Pamisyl (TN), Paser (TN), 4-Aminosalicyclic acid, Spectrum_000042, .gamma.-Aminosalicylate, Opera_ID_614, Spectrum2_000001, Spectrum3_000297, Spectrum4_000145, Spectrum5_000804, para-amino-salicyclic acid, WLN: ZR CQ DVQ, Salicyclic acid, 4-amino-, SCHEMBL2262, CHEMBL1169, BSPBio_001834, KBioGR_000590, KBioSS_000422, 4-14-00-01967 (Beilstein Handbook Reference), MLS001148121, 4-Aminosalicylic acid, 99%, BIDD:GT0175, DivK1c_000350, 4-amino-2-hydroxobenzoic acid, SPBio_000001, p-Aminosalicylic acid STANDARD, DTXSID2022591, BDBM48319, HMS501B12, HY-I0447R, KBio1_000350, KBio2_000422, KBio2_002990, KBio2_005558, KBio3_001334, 4-Aminobenzoic acid, 2-hydroxy-, 4-Aminosalicylic acid (Standard), 4-azanyl-2-oxidanyl-benzoic acid, cid_11988145, NINDS_000350, AMINOSALICYLIC ACID [HSDB], HMS2090I07, HMS2093L14, HMS2236I04, HMS3371A17, HMS3715M08, KUC106682N, AMINOSALICYLIC ACID [VANDF], P-AMINOSALICYLIC ACID [MI], AMINOSALICYLIC ACID [MART.], BCP18565, HY-I0447, AMINOSALICYLIC ACID [USP-RS], AMINOSALICYLIC ACID [WHO-DD], CCG-39969, s5211, STL163955, AKOS000121200, CS-W023102, DB00233, FA10792, PB47849, 4-AMINO,2-HYDROXY-BENZOIC ACID, IDI1_000350, AMINOSALICYLIC ACID [ORANGE BOOK], NCGC00018110-01, NCGC00018110-02, NCGC00018110-03, NCGC00018110-04, AC-12894, AS-11043, SY001079, AMINOSALICYLIC ACID [USP MONOGRAPH], KSC-11-207-13, SBI-0051279.P003, SBI-0051279.P004, DB-054818, MESALAZINE IMPURITY E [EP IMPURITY], A0420, NS00010608, EN300-18730, C02518, D00162, NEOPASALATE COMPONENT AMINOSALICYLIC ACID, P17508, AB00051913-20, Q229924, SR-01000002990-4, SR-01000002990-6, 4-Aminosalicylic acid, Vetec(TM) reagent grade, 99%, BRD-K80267133-001-17-7, BRD-K80267133-001-18-5, BRD-K80267133-001-19-3, Z90121065, F2191-0245, para-aminosalicylic acid, Aminosalicylic acid, 4-aminosalicylate, Aminosalicylic acid, United States Pharmacopeia (USP) Reference Standard, 4-Aminosalicylic acid, Pharmaceutical Secondary Standard, Certified Reference Material, InChI=1/C7H7NO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,8H2,(H,10,11
Topological Polar Surface Area 83.6
Hydrogen Bond Donor Count 3.0
Heavy Atom Count 11.0
Isotope Atom Count 0.0
Molecular Complexity 160.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P18031, P00915, P00918, n.a., B2RXH2, P10636, Q962Y6, P08253, P03956, P08254, P22894, P09917, P29477, P15917, P14780, O42713, Q96KQ7, P84022, O60656, P35354, P02768, Q9WU19, P08684, P10635, P11712
Iupac Name 4-amino-2-hydroxybenzoic acid
Nih Violation False
Prediction Hob 1.0
Target Id NPT947, NPT233, NPT48, NPT51
Xlogp 1.3
Is Pains False
Molecular Formula C7H7NO3
Prediction Swissadme 0.0
Inchi Key WUBBRNOQWQTFEX-UHFFFAOYSA-N
Fcsp3 0.0
Logs -2.231
Rotatable Bond Count 1.0
Logd 0.392
Compound Name 4-Aminosalicylic acid
Prediction Hob Swissadme 0.0
Exact Mass 153.043
Formal Charge 0.0
Brenk Violation True
Monoisotopic Mass 153.043
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 153.14
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -1.9586857636363635
Inchi InChI=1S/C7H7NO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,8H2,(H,10,11)
Smiles C1=CC(=C(C=C1N)O)C(=O)O
Nring 1.0
Defined Bond Stereocenter Count 0.0