| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 25 | Yes |
Popular Name: 4-amino-N-[(3S,4S)-1-(3-aminopropyl)-3-methoxy-4-piperidyl]-5-chloro-2-methoxy-benzamide 4-amino-N-[(3S,4S)-1-(3-aminopro…
| 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) | 0.95 | 0.75 | -52.55 | 6 | 7 | 1 | 104 | 371.889 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.95 | 2.98 | -117.74 | 7 | 7 | 2 | 106 | 372.897 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4906643; US4975439; US5041454; US5130312 | IBM Patent Data |
