In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2011 | 16 | Yes |
Popular Name: [(3R)-1-cyclopropyl-3-(1-piperidyl)pyrrolidin-3-yl]methanamine [(3R)-1-cyclopropyl-3-(1-piperid…
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) | 0.64 | 3.32 | -31.6 | 3 | 3 | 1 | 34 | 224.372 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.64 | 1.61 | -42.67 | 3 | 3 | 1 | 34 | 224.372 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 5.36 | -94.79 | 4 | 3 | 2 | 35 | 225.38 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 3.47 | -119.59 | 4 | 3 | 2 | 35 | 225.38 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 2.97 | -26.76 | 3 | 3 | 1 | 34 | 224.372 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.64 | 5.87 | -217.66 | 5 | 3 | 3 | 37 | 226.388 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.64 | 4.13 | -102.73 | 4 | 3 | 2 | 35 | 225.38 | 3 | ↓ |