In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 16 | Yes |
Popular Name: (2R)-1-[(2S)-piperazine-2-carbonyl]pyrrolidine-2-carboxamide (2R)-1-[(2S)-piperazine-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) | -1.58 | -2.06 | -55.05 | 5 | 6 | 1 | 92 | 227.288 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.58 | -3.41 | -16.42 | 4 | 6 | 0 | 87 | 226.28 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.