In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: N-(2-pyrrolidin-1-ylethyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine N-(2-pyrrolidin-1-ylethyl)-1-(2,…
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) | 1.88 | 3.48 | -40.62 | 2 | 3 | 1 | 23 | 280.358 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 2.28 | -3.49 | 1 | 3 | 0 | 19 | 279.35 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 5.93 | -116.4 | 3 | 3 | 2 | 24 | 281.366 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 4.74 | -34.54 | 2 | 3 | 1 | 20 | 280.358 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 6.84 | -85.49 | 3 | 3 | 2 | 21 | 281.366 | 6 | ↓ |