In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 19 | Yes |
Popular Name: (4R)-N-[2-(4-methyl-1-piperidyl)ethyl]-4,5,6,7-tetrahydrobenzothiophen-4-amine (4R)-N-[2-(4-methyl-1-piperidyl)…
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) | 2.37 | 8.55 | -35.83 | 2 | 2 | 1 | 16 | 279.473 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 9.73 | -122.89 | 3 | 2 | 2 | 21 | 280.481 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.