In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 20 | Yes |
Popular Name: 1-[1-[(3R)-3-(aminomethyl)quinuclidin-3-yl]-4-piperidyl]-N,N-dimethyl-methanamine 1-[1-[(3R)-3-(aminomethyl)quinuc…
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 |
---|---|---|---|---|---|---|---|---|---|---|
Hi High (pH 8-9.5) | 0.67 | 5.53 | -74.75 | 4 | 4 | 2 | 38 | 282.476 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.67 | 3.3 | -99.11 | 4 | 4 | 2 | 39 | 282.476 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 6.38 | -173.76 | 5 | 4 | 3 | 39 | 283.484 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 5.16 | -200.43 | 5 | 4 | 3 | 40 | 283.484 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 5.74 | -174.5 | 5 | 4 | 3 | 40 | 283.484 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.67 | 7.39 | -316.75 | 6 | 4 | 4 | 41 | 284.492 | 4 | ↓ |