In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2011 | 21 | Yes |
Popular Name: (3R)-3-methyl-1-[2-oxo-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl]piperidine-3-carboxylic (3R)-3-methyl-1-[2-oxo-2-[[(1S)-…
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) | 2.07 | 7.85 | -47.64 | 2 | 5 | 0 | 74 | 310.419 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 6.06 | -47.44 | 1 | 5 | -1 | 72 | 309.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.