In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 15 | Yes |
Popular Name: 2-[(2S)-1-cyclopentyl-2-piperidyl]-N-methyl-ethanamine 2-[(2S)-1-cyclopentyl-2-piperidy…
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) | 2.69 | 7.18 | -97.49 | 3 | 2 | 2 | 21 | 212.381 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.69 | 5.74 | -29.15 | 2 | 2 | 1 | 16 | 211.373 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.69 | 5.41 | -38.1 | 2 | 2 | 1 | 20 | 211.373 | 4 | ↓ |