| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 21 | Yes |
Popular Name: (2R)-2-(5-chloro-2-thienyl)-2-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]ethanamine (2R)-2-(5-chloro-2-thienyl)-2-[4…
| 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) | 2.63 | 7.63 | -90.67 | 4 | 3 | 2 | 35 | 329.941 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.63 | 6.67 | -34.11 | 3 | 3 | 1 | 34 | 328.933 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.63 | 9.04 | -197.86 | 5 | 3 | 3 | 37 | 330.949 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
