In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 18 | Yes |
Popular Name: 4-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxylic 4-methyl-1-[(2S)-piperidine-2-ca…
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) | 0.61 | 5.43 | -66.09 | 2 | 5 | 0 | 77 | 254.33 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.61 | 4.18 | -48.54 | 1 | 5 | -1 | 72 | 253.322 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.