2-Aminobenzimidazole
PubChem CID: 13624
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| Compound Synonyms | 2-AMINOBENZIMIDAZOLE, 934-32-7, 1H-Benzimidazol-2-amine, 1H-Benzo[d]imidazol-2-amine, 2-Iminobenzimidazoline, Benzimidazole, 2-amino-, 2-Amino-1H-benzimidazole, Benzimidazol-2-ylamine, 2-Benzimidazolamine, 2-Amino benzimidazole, USAF EK-4037, Caswell No. 033AA, 1H-1,3-benzodiazol-2-amine, MFCD00005596, CCRIS 4354, NSC 7628, EINECS 213-280-6, 2-aminobenzimidazol, NSC 27793, BRN 0116525, 2-amino-benzimidazole, DTXSID1024465, CHEBI:27822, AI3-60094, E65DE7521V, NSC-7628, NSC-27793, 1H-benzimidazol-2-ylamine, 1H-Benzoimidazol-2-ylamine, AMINOBENZIMIDAZOLE, 2-, CHEMBL305513, DTXCID004465, 5-25-10-00372 (Beilstein Handbook Reference), 162938-41-2, 2H-Benzimidazol-2-imine,1,3-dihydro-(9CI), WLN: T56 BM DNJ CZ, aminobenzimidazole, CAS-934-32-7, UNII-E65DE7521V, 2fpz, benzimidazole amine, benzimidazole-amine, 2-ammobenzimidazole, AX7, 2-aminobenzoimidazole, 2-benzimidazolylamine, Carbendazim metabolite, 2fx6, 1H-benzoimidazol-2-amine, Imidazole C-2 deriv. 3, SCHEMBL9098, 2-Aminobenzimidazole, 97%, Oprea1_243328, YSWG454, JMC524454 Compound 5, MLS001074865, 1H-benz[d]imidazole-2-amine, BIDD:GT0837, 1H-1,3-benzimidazol-2-amine, BDBM7960, SCHEMBL2475507, SCHEMBL3350089, NSC7628, HMS1741L08, HMS2865C12, SRCA-00001, CS-D1373, HY-Y0410, NSC27793, STR00452, 2-AB (2-Amine-1H-benzimidazole), Tox21_201949, Tox21_303120, BBL033933, STL283126, AKOS000104081, FA00990, SB75578, NCGC00091178-01, NCGC00091178-02, NCGC00257027-01, NCGC00259498-01, AC-15858, SMR000019082, SY032901, TS-01718, 1,3-dihydro-benzoimidazol-2-ylidene amine, DB-346953, A0850, EU-0067838, NS00010870, EN300-18977, W10172, AQ-738/40188880, 2-Iminobenzimidazoline SRIRAMCHEM-aminobenzimidazole, Q27103356, 2-Aminobenzimidazole, PESTANAL(R), analytical standard, F0266-1828, Z104378302 |
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| Topological Polar Surface Area | 54.7 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 126.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P00749, Q581W1, P00352, Q03164, O00167, P19793, P10275, Q03181, Q9NUW8, Q16853, O08590, O94782, P27986, P42336, P42336, P36639, P19838, P05412 |
| Iupac Name | 1H-benzimidazol-2-amine |
| Prediction Hob | 1.0 |
| Target Id | NPT1654, NPT94, NPT4106 |
| Xlogp | 0.9 |
| Molecular Formula | C7H7N3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | JWYUFVNJZUSCSM-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -1.904 |
| Rotatable Bond Count | 0.0 |
| Logd | 0.542 |
| Compound Name | 2-Aminobenzimidazole |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 133.064 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 133.064 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 133.15 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.9048547999999998 |
| Inchi | InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10) |
| Smiles | C1=CC=C2C(=C1)NC(=N2)N |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Ligusticum Chuanxiong (Plant) Rel Props:Source_db:npass_chem_all