| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 26 | Yes |
Popular Name: 4-amino-N-[(3S,4S)-1-(4-aminobutyl)-3-methoxy-4-piperidyl]-5-chloro-2-methoxy-benzamide 4-amino-N-[(3S,4S)-1-(4-aminobut…
| 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) | 1.22 | 3.76 | -109.12 | 7 | 7 | 2 | 106 | 386.924 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 1.54 | -51.74 | 6 | 7 | 1 | 104 | 385.916 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4906643; US5130312 | IBM Patent Data |
