In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 17 | Yes |
Popular Name: (4-allylpiperazin-1-yl)-[(2S)-morpholin-2-yl]methanone (4-allylpiperazin-1-yl)-[(2S)-mo…
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) | -0.53 | 1.98 | -53.92 | 2 | 5 | 1 | 49 | 240.327 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.53 | 0.63 | -9.6 | 1 | 5 | 0 | 45 | 239.319 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.53 | 4.21 | -108.79 | 3 | 5 | 2 | 51 | 241.335 | 3 | ↓ |