In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 19 | Yes |
Popular Name: 1-[(2S)-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pentan-1-one 1-[(2S)-2-(piperazine-1-carbonyl…
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) | 0.64 | 4.78 | -17.23 | 1 | 5 | 0 | 53 | 267.373 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 6.16 | -55.64 | 2 | 5 | 1 | 57 | 268.381 | 4 | ↓ |