Bioactive Compound Details
| BioID | bio199393 |
|---|---|
| Name | PIRBENICILLIN SODIUM |
| ChEMBL ID | CHEMBL2106916 |
| Molecular Formula | C24H25N6NaO5S |
| Molecular Weight | 532.56 |
| Molecular Weight (Monoisotopic) | 510.1685 |
| Type | Small molecule |
| Max Phase | Unknown |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | CP-33,994-2|CP-33994-2|PIRBENICILLIN SODIUM |
| Smiles | CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)CNC(=N)c3ccncc3)c3ccccc3)C(=O)N2[C@H]1C(=O)[O-].[Na+] |
| Inchi | InChI=1S/C24H26N6O5S.Na/c1-24(2)18(23(34)35)30-21(33)17(22(30)36-24)29-20(32)16(13-6-4-3-5-7-13)28-15(31)12-27-19(25)14-8-10-26-11-9-14;/h3-11,16-18,22H,12H2,1-2H3,(H2,25,27)(H,28,31)(H,29,32)(H,34,35);/q;+1/p-1/t16-,17-,18+,22-;/m1./s1 |
| Inchi Key | LWRGPIPUJPCPAY-HSRLECSKSA-M |
| Molecular Species | ZWITTERION |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.11 |
| Records Key | ['PIRBENICILLIN SODIUM'] |
| Records Name | ['PIRBENICILLIN SODIUM'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
