Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| April 1st, 2009 |
29 |
Yes
|
Other Names:
(4R,7S,7aR,12bS)-3-methyl-9-(2-morpholin-4-ylethoxy)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-ol
(5alpha,6alpha)-17-methyl-3-[2-(morpholin-4-yl)ethoxy]-7,8-didehydro-4,5-epoxymorphinan-6-ol;03-(2-Morpholinoethyl)-Morphine;3-(2-(4-Morpholinyl)ethyl)morphine;3-(2-Morpholinoethyl)morphine;3-Morpholylaethylmorphin;3-Morpholylathylmorphin;3-O-(2-Morpholin
3-(2-(4-Morpholinyl)ethyl)morphine; 3-(2-Morpholinoethyl)morphine; 3-Morpholylaethylmorphin; 3-morpholinoethylmorphine; 7,8-Didehydro-4,5-alpha-epoxy-17-methyl-3-(2-morpholinoethoxy)morphinan-6-alpha-ol; Morpholinylethylmorphine; Tetrahydro-1,4-oxazinylme
3-(2-(4-Morpholinyl)ethyl)morphine; 3-Morpholylaethylmorphin [German]; 7,8-Didehydro-4,5-alpha-epoxy-17-methyl-3-(2-morpholinoethoxy)morphinan-6-alpha-ol; 7,8-didehydro-4,5 alpha-epoxy-17-methyl-3-(2-morpholinoethoxymorphinan-6 alpha-ol); Adaphol; C23H30N
398
509-67-1; D07385; Pholcodine (INN); Pholcodine linctus (TN)
folcodina; pholcodine; pholcodinum
INN
MFCD00866841
MI)
Pholcodine (BAN
Download:
MOL2
SDF
SMILES
Flexibase
Physical Representations
|
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
|
Ref
Reference (pH 7)
|
1.29 |
5.4 |
-51.9 |
2 |
6 |
1 |
56 |
399.511 |
4 |
↓
|
Vendor Notes
| Note Type |
Comments |
Provided By |
| Molecular_Solubility |
2.749 |
Bitter DB |
| PUBCHEM_PATENT_ID |
EP0108399A2; EP0110186A1; EP0129284A2; EP0129285A2; EP0129285B1; EP0290482A1; EP0290482B1; EP0298368A2; EP0298368B1; EP0327766A2; EP0335545A2; EP0335545B2; EP0415693A1; EP0420102A3; EP0539493A1; EP0539493B1; EP0608850A1; EP0608850B1; EP0608893A1; EP071263 |
IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.
