In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-cyclopropyl-N-ethyl-quinuclidin-3-amine (3R)-3-(aminomethyl)-N-cycloprop…
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) | 0.61 | 3.74 | -107.76 | 4 | 3 | 2 | 35 | 225.38 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.61 | 1.28 | -42.74 | 3 | 3 | 1 | 34 | 224.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.61 | 3.72 | -34.37 | 3 | 3 | 1 | 34 | 224.372 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 3.09 | -27.56 | 3 | 3 | 1 | 34 | 224.372 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 3.04 | -111.65 | 4 | 3 | 2 | 35 | 225.38 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.61 | 5.49 | -90.63 | 4 | 3 | 2 | 35 | 225.38 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.61 | 5.47 | -205.32 | 5 | 3 | 3 | 37 | 226.388 | 4 | ↓ |