|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
16
Total Number of Articles : 16
|
| PubChem |
107771
|
| Molecular Formula |
C29H32ClN5O2 |
| SMILES |
COC1=NC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NC4=CC(=C(C(=C4)CN5CCCC5)O)CN6CCCC6 |
| InChI |
InChI=1S/C29H32ClN5O2/c1-37-26-9-8-24-28(33-26)27(23-7-6-21(30)16-25(23)32-24)31-22-14-19(17-34-10-2-3-11-34)29(36)20(15-22)18-35-12-4-5-13-35/h6-9,14-16,36H,2-5,10-13,17-18H2,1H3,(H,31,32) |
| synonyms |
- Pyronaridine
- 74847-35-1
- Malaridine
- Pyronaridine [INN]
- 2-Methoxy-7-chloro-10-(3',5'-bis(pyrrolin-1-ylmethyl)-4'-hydroxyphenylamino)benzo(b)-1,5-naphthyridine
- TD3P7Q3SG6
- 4-((7-Chloro-2-methoxybenzo(b)-1,5-naphthyridin-10-yl)amino)-2,6-bis(1-pyrrolidinylmethyl)phenol
- 4-[(7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-yl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol
- 4-[(7-chloro-2-methoxy-1,5-dihydrobenzo[b][1,5]naphthyridin-10-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one
- Benzonaphthyridine 7351
- UNII-TD3P7Q3SG6
- Pyronaridine?
- 4-((7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-yl)amino)-2,6-bis(pyrrolidin-1-ylmethyl)phenol
- PYRONARIDINE [MI]
- MLS006011911
- CHEMBL35228
- PYRONARIDINE [WHO-DD]
- SCHEMBL247252
- SCHEMBL1650244
- BDBM53353
- GTPL10086
- DTXSID60996354
- CHEBI:135951
- cid_20833062
- AMY18340
- BCP19128
- EX-A2938
- Malaridine;Benzonaphthyridine 7351
- ZCA84735
- BBL010793
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| Properties |
| Property |
Value |
| MW |
518.0 g/mol |
| HBD |
2 |
| HBA |
7 |
| Rotatable Bond Count |
7 |
| Exact Mass |
517.2244530 g/mol |
| Monoisotopic Mass |
517.2244530 g/mol |
| Heavy Atom Count |
37 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
707 |
| xlogp |
5.3 |
| Topological Polar Surface Area |
73.8 |
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