| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 5th, 2009 | 14 | No |
Popular Name: Guanethidine Guanethidine
((2-Hexahydro-1(2H)-azocinyl)ethyl)guanidine
(2-(Octahydro-1-azocinyl)ethyl)guanidine
.Beta.-1-Azacyclooctylethylguanidine
1-(2-azocan-1-ylethyl)guanidine
1-[2-(azocan-1-yl)ethyl]guanidine
2-(1'-Azacyclooctyl)ethylguanidine
2-(1-N,N-Heptamethyleneimino)ethylguanidine
2-[2-(azocan-1-yl)ethyl]guanidine
Azocine, 1-((2-(aminoiminomethyl)amino)ethyl)octahydro-
Azocine, 1-(2-guanidinoethyl)octahydro-
Guanethidine Monosulfate;Guanethidine Monosulphate;Guanethidine Sulphae
Guanidine, (2-(hexahydro-1(2H)-azocinyl)ethyl)-
Guanidine, N-[2-(hexahydro-1(2H)-azocinyl)ethyl]-
Guanidine, [2-(hexahydro-1(2H)-azocinyl)ethyl]-
Heptamethylenimine, 1-(2-guanidinoethyl)-
None
| 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) | 0.99 | 5.12 | -94.46 | 6 | 4 | 2 | 70 | 200.33 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 5.08 | -39.47 | 5 | 4 | 1 | 66 | 199.322 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 2.25e+00 g/l | DrugBank-approved |
No pre-computed analogs available. Try a structural similarity search.