| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2008 | 11 | No |
Popular Name: Etidronate disodium Etidronate disodium
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1159812-97-1 , 2666-14-0 , 2809-21-4 , 29329-71-3 , 358730-93-5 , 3794-83-0 , 7414-83-7 , [14860-53-8] , [3794-83-0] , [67953-76-8] , [7414-83-7]
"1-Hydroxyethane-1,1-diphosphonic acid, 60% [60% solution in H2O]"
(1-Hydroxy-1-phosphono-ethyl)-phosphonic acid
(1-hydroxyethane-1,1-diyl)bis(phosphonic acid)
(1-Hydroxyethane-1,1-diyl)diphosphonic acid
(1-Hydroxyethane-1,1-diyl)diphosphonic acid (ca. 60% in Water, ca. 4.2mol/L)
(1-Hydroxyethane-1,1-diyl)diphosphonic acid disodium salt
(1-Hydroxyethylidene)bis-phosphonic acid tetrasodium salt
(1-hydroxyethylidene)bisphosphonic acid, sodium salt
1-Hydroxyethane-1,1-diphosphonic acid
1-Hydroxyethane-1,1-diphosphonic Acid (ca. 60% in Water, ca. 4.2mol/L)
1-Hydroxyethanediphosphonic acid potassium salt
1-Hydroxyethanediphosphonicacidsodiumsalt
1-Hydroxyethylidene-1,1-bis-(phosphonic acid) trisodium salt
1-Hydroxyethylidene-1,1-diphosphonic acid
1-HYDROXYETHYLIDENE-1,1-DIPHOSPHONICACIDTRISODIUMSALT
1-Hydroxyethylidenebis(phosphonic acid)
1-Hydroxyethylidenebis(phosphonic acid), 96%
1-Hydroxyethylidenediphosphonic acid
2809-21-4; D02373; Etidronic acid (USAN/INN)
7414-83-7; Etidronic acid, disodium salt; Prestwick_1061
Acide etidronique [INN-French]
acide etidronique; acido etidronico; acidum etidronicum; etidronic acid
Acido etidronico [INN-Spanish]
Acidum etidronicum [INN-Latin]
Cintichem Technetium 99m Hedspa
Disodium (1-hydroxyethylidene)diphosphonate
etidronic acid dianion; hydroxyethylidenebisphosphonate
Hydroxyethanediphosphonic acid
Oxyethylidenediphosphonic acid
Potassium salt of(1-Hydroxy ethylidene)diphosphonate
Technetium Tc 99M Etidronate (USP); Technetium Tc-99M Etidronate Kit (FDA)
Technetium Tc-99m Etidronate Kit (FDA); Technetium Tc 99m Etidronate (USP)
Tetrapotassium (1-hydroxyethylidene)bisphosphonate
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -2.43 | -5.34 | -225.71 | 2 | 7 | -3 | 144 | 203.003 | 2 | ↓ |
| Hi High (pH 8-9.5) | -2.43 | -4.24 | -364.14 | 1 | 7 | -4 | 147 | 201.995 | 2 | ↓ |
| Mid Mid (pH 6-8) | -2.43 | -6.47 | -111.47 | 3 | 7 | -2 | 141 | 204.011 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 1.15e+01 g/l | DrugBank-approved |
| Purity | 95% | Fluorochem |
| Indications | bisphosphonate | KeyOrganics Bioactives |
| Indications | bisphosponate | KeyOrganics Bioactives |
| mechanism | Bone resorption inhibitor | IBScreen Bioactives |
| mechanism | Chelator | IBScreen Bioactives IBScreen Bioactives |
| mechanism | Chelator; Bone resorption inhibitor | ZereneX Building Blocks |
| Indications | osteoporosis | KeyOrganics Bioactives |
| Target | Others | Selleck Chemicals |
| Target | phosphatase | Selleck Chemicals |
| UniProt Database Links | RBSK_HUMAN; RBSK_MOUSE; TRAI1_ECOLI | ChEBI |
| mechanism | Reduces the number of osteoclasts in active bone turnover-sites | IBScreen Bioactives |
| biological_use | This medicine is used to treat Paget's Disease, and to treat conditions of irregular bone growth due to hip fracture or spinal cord injury | IBScreen Bioactives |
| UniProt Database Links | TRAI1_ECOLI | ChEBI |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50212-2-O | Escherichia Coli (cluster #2 Of 7), Other | Other | 330 | 0.82 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50212 | Z50212 | Escherichia Coli | 10000 | 0.64 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.