Ibandronate - Small Molecule (ID:10258-110)
| HMS LINCS ID: |
10258-110
|
| Name: | Ibandronate |
| Alternative Names: | Boniva |
| LINCS ID: | LSM-4279 |
| PubChem CID: | 44828485 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 318.09 |
| InChi: | InChI=1S/C9H23NO7P2/c1-3-4-5-7-10(2)8-6-9(11,18(12,13)14)19(15,16)17/h11H,3-8H2,1-2H3,(H2,12,13,14)(H2,15,16,17)/p-1 |
| InChi Key: | MPBVHIBUJCELCL-UHFFFAOYSA-M |
| SMILES: | CCCCCN(C)CCC(O)(P(=O)(O)O)P(=O)(O)[O-] |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
FDPS |
Batch Information for HMSL10258-110-1:
| HMS LINCS Batch ID: | 10258-110-1 |
| Provider: | Sigma-Aldrich |
| Provider Batch ID: | |
| Salt: | 110 |
| Molecular Formula: | C9H22NNaO7P2 |
| Molecular Weight: | 341.21 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2012-11-14 |
| Most Recent Update: | 2016-12-02 |
(equivalent to 100 nM ≤ Kd < 1µM)