| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 18 | Yes |
Popular Name: N-[[(2S)-1-(cyclopentylmethyl)-2-piperidyl]methyl]-2-methyl-propan-2-amine N-[[(2S)-1-(cyclopentylmethyl)-2…
| 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) | 3.99 | 9.88 | -107.5 | 3 | 2 | 2 | 21 | 254.462 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 8.12 | -31.15 | 2 | 2 | 1 | 20 | 253.454 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 8.81 | -30.1 | 2 | 2 | 1 | 16 | 253.454 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
