BIAdb Nicocodine 2771
From DrugPedia: A Wikipedia for Drug discovery
(Difference between revisions)
m |
(→External Links) |
||
| (One intermediate revision not shown.) | |||
| Line 82: | Line 82: | ||
[http://crdd.osdd.net/raghava/biadb/detail.php?id=2771 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=2771 Link to BIAdb Database] | ||
| + | [[Category:BIAdb]] | ||
Current revision
| BIAdb Nicocodine 2771
| |
| Systematic (IUPAC) name | |
| N/A | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C24H24N2O4 |
| Mol. mass | 404.45836 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
N/A
[edit] Function
Unknown
[edit] General Properties
*Molecular Weight
404.45836
*Exact Mass
404.173607
*Molecular Formula
C24H24N2O4
*IUPAC NAME
N/A
*Canonical Smiles
CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(C=C4)OC(=O)C6=CN=CC=C6
*Isomeric Smiles
CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)OC(=O)C6=CN=CC=C6
*XLogP
2.3
*Hydrogen bond donor
0
*Hydrogen bond acceptor
6
*Rotational Bond Count
4
*Topological Polar Surface Area
60.9
