| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2005 | 12 | Yes |
Popular Name: Kynuramine Kynuramine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 363-36-0 , 36681-58-0
3-Amino-1-(2-aminophenyl)-1-Propanone;Diaminopropiophenone
3-amino-1-(2-aminophenyl)-propan-1-one
3-amino-1-(2-aminophenyl)propan-1-one dihydrochloride
| 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) | -0.03 | 1.33 | -48.47 | 5 | 3 | 1 | 71 | 165.216 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.03 | 0.94 | -5.38 | 4 | 3 | 0 | 69 | 164.208 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.