In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-1-(2-pyridyl)piperidin-4-amine N-[(3R)-1-cyclopropylpyrrolidin-…
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) | 1.83 | 7.12 | -90.08 | 3 | 4 | 2 | 37 | 288.439 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 6.79 | -42.91 | 2 | 4 | 1 | 36 | 287.431 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 5.75 | -4.44 | 1 | 4 | 0 | 31 | 286.423 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 8.09 | -35.99 | 2 | 4 | 1 | 33 | 287.431 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 8.4 | -71.47 | 3 | 4 | 2 | 34 | 288.439 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.83 | 9.45 | -174.5 | 4 | 4 | 3 | 38 | 289.447 | 4 | ↓ |