In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 21 | Yes |
Popular Name: (2R)-2-[4-(1-piperidylmethyl)-1-piperidyl]-2-(2-thienyl)ethanamine (2R)-2-[4-(1-piperidylmethyl)-1-…
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) | 2.34 | 7.57 | -88.21 | 4 | 3 | 2 | 35 | 309.523 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 6.76 | -33.6 | 3 | 3 | 1 | 34 | 308.515 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 8.79 | -94.28 | 4 | 3 | 2 | 35 | 309.523 | 5 | ↓ |