In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 23 | Yes |
Popular Name: (4-ethylpiperazin-1-yl)-[(3S)-1-(furan-3-carbonyl)-3-piperidyl]methanone (4-ethylpiperazin-1-yl)-[(3S)-1-…
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) | 0.24 | 4.59 | -10.36 | 0 | 6 | 0 | 57 | 319.405 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.24 | 6.81 | -42.36 | 1 | 6 | 1 | 58 | 320.413 | 3 | ↓ |