In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 20 | Yes |
Popular Name: (3R)-1-[(2R)-piperidine-2-carbonyl]-3-propyl-piperidine-3-carboxylic (3R)-1-[(2R)-piperidine-2-carbon…
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) | 1.50 | 7.04 | -53.55 | 2 | 5 | 0 | 77 | 282.384 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 5.79 | -53.04 | 1 | 5 | -1 | 72 | 281.376 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.