| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(3-bromophenyl)-N'-(1-ethyl-4-piperidyl)-N'-methyl-propane-1,3-diamine (1S)-1-(3-bromophenyl)-N'-(1-eth…
| 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) | 1.31 | 6.93 | -33.11 | 3 | 3 | 1 | 34 | 355.344 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 7.23 | -97.58 | 4 | 3 | 2 | 35 | 356.352 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.31 | 9.18 | -104.56 | 4 | 3 | 2 | 35 | 356.352 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
