| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 19 | Yes |
Popular Name: N'-[(1S,4aR,8aS)-decalin-1-yl]-N,N-diethyl-propane-1,3-diamine N'-[(1S,4aR,8aS)-decalin-1-yl]-N…
| 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) | 4.20 | 10.44 | -104.18 | 3 | 2 | 2 | 21 | 268.489 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 8.28 | -38.09 | 2 | 2 | 1 | 20 | 267.481 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5145874; US5187299; US5196542; US5274089; US5334712; US5373095 | IBM Patent Data |
