Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| January 17th, 2014 |
0 |
Yes
|
Other Names:
(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide; (Z)-but-2-enedioic acid
erg-
erg-; -vin-
vin-
113-42-8; D08207; Ergotyl (TN); Methylergometrine (INN)
321
57432-61-8; D00680; Methergine (TN); Methylergometrine maleate (JP16); Methylergonovine maleate (USP)
9,10-Didehydro-N-((S)-1-(hydroxymethyl)propyl)-6-methylergoline-8beta-carboxamide maleate (1:1) (salt); C20H25N3O2; EINECS 260-734-4; Erezingen; Ergoline-8-carboxamide, 9,10-didehydro-N-((1S)-1-(hydroxymethyl)propyl)-6-methyl-, (8beta)-, (2Z)-2-butenedioa
BAN); Methylergometrine Maleate (JAN); Methylergonovine Maleate (FDA
BAN); Methylergonovine Maleate (FDA
Basofortina
BRD-K34685430-050-04-2
INN); Methylergonovine Maleate (FDA
Metenarin
Methergen
Methergin
Methergine
Methylergobasin
Methylergobasin;Methylergobasine;Methylergobrevin;Methylergometrin;Methylergometrine;Methylergonovin;Methylergonovine maleate
Methylergobasine
Methylergobrevin
Methylergometrin
Methylergometrine
Methylergometrine (BAN
Methylergometrine (INN
Methylergonovin
methylergonovine maleate
Norforms
Partergin
Ryegonovin
Spametrin-M
USP)
USP); Methylergometrine Maleate (JAN)
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 |
Vendor Notes
No pre-computed analogs available. Try a structural similarity search.
