| BioID | bio1881 |
|---|
| Name | RIGOSERTIB SODIUM |
|---|
| ChEMBL ID | CHEMBL2013119 |
|---|
| Molecular Formula | C21H24NNaO8S |
|---|
| Molecular Weight | 473.48 |
|---|
| Molecular Weight (Monoisotopic) | 451.1301 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 3 |
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| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
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| Synonyms | Estybon|ON 01910 SODIUM|ON 01910.NA|ON-01910|ON-01910 SODIUM|ON-01910.NA|ON-01910.Na|ON01910 SODIUM|RIGOSERTIB SODIUM|Rigosertib Sodium|SYB C-1101 |
|---|
| Smiles | COc1cc(OC)c(/C=C/S(=O)(=O)Cc2ccc(OC)c(NCC(=O)[O-])c2)c(OC)c1.[Na+] |
|---|
| Inchi | InChI=1S/C21H25NO8S.Na/c1-27-15-10-19(29-3)16(20(11-15)30-4)7-8-31(25,26)13-14-5-6-18(28-2)17(9-14)22-12-21(23)24;/h5-11,22H,12-13H2,1-4H3,(H,23,24);/q;+1/p-1/b8-7+; |
|---|
| Inchi Key | VLQLUZFVFXYXQE-USRGLUTNSA-M |
|---|
| Molecular Species | ACID |
|---|
| Targets | 53.0 |
|---|
| Bioactivities | 108.0 |
|---|
| Np Likeness Score | -0.24 |
|---|
| Records Key | ['28, ON 01910.Na, ESTYBON', 'RIGOSERTIB SODIUM', 'ON01910.Na, Estybon', 'Rigosertib Sodium', 'RIGOSERTIB SODIUM', 'ON 01910.Na', '1; ON01910'] |
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| Records Name | [Sodium(E)-2-(2-Methoxy-5-((2',4',6'-trimethoxystyrylsulfonyl)methyl)phenylamino)acetate", 'RIGOSERTIB SODIUM', 'sodium(E)-2-(2-methoxy-5-((2,4,6-trimethoxystyrylsulfonyl)methyl)phenylamino)acetate', 'Rigosertib Sodium', 'RIGOSERTIB SODIUM', 'Rigosertib sodium', 'Rigosertib']" |
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| Withdrawn Flag | False |
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| Orphan | 0 |
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