In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 19 | No |
Popular Name: 1-[(3S)-3-(diethylamino)pyrrolidine-1-carbonyl]cyclobutanecarboxylic 1-[(3S)-3-(diethylamino)pyrrolid…
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) | 0.55 | 7.16 | -62.2 | 1 | 5 | 0 | 65 | 268.357 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.55 | 5.05 | -48.01 | 0 | 5 | -1 | 64 | 267.349 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.