In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 22 | Yes |
Popular Name: (2S)-N-[5-(4-ethylpiperazin-1-yl)pentyl]-5-oxo-pyrrolidine-2-carboxamide (2S)-N-[5-(4-ethylpiperazin-1-yl…
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) | 0.26 | 2.93 | -51.25 | 3 | 6 | 1 | 66 | 311.45 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.26 | 0.66 | -16.43 | 2 | 6 | 0 | 65 | 310.442 | 8 | ↓ |