In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 16 | Yes |
Popular Name: N,N-dimethyl-1-[(1R,2S)-2-(methylamino)cyclopentyl]piperidin-4-amine N,N-dimethyl-1-[(1R,2S)-2-(methy…
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) | 1.43 | 6.23 | -85.6 | 3 | 3 | 2 | 24 | 227.396 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 5.25 | -110.45 | 3 | 3 | 2 | 24 | 227.396 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 5.62 | -30.74 | 2 | 3 | 1 | 20 | 226.388 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.43 | 7.85 | -91.39 | 3 | 3 | 2 | 21 | 227.396 | 3 | ↓ |