In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 18 | Yes |
Popular Name: (3R)-1-[2-(3-bromo-2-thienyl)-2-oxo-ethyl]piperidine-3-carboxamide (3R)-1-[2-(3-bromo-2-thienyl)-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) | 1.63 | 4.7 | -41.45 | 3 | 4 | 1 | 65 | 332.243 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 2.53 | -11.45 | 2 | 4 | 0 | 63 | 331.235 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.