In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 18 | Yes |
Popular Name: (2S)-N-[2-(4-methylpiperazin-1-yl)ethyl]morpholine-2-carboxamide (2S)-N-[2-(4-methylpiperazin-1-y…
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) | -1.39 | 0.96 | -96.77 | 4 | 6 | 2 | 63 | 258.366 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.39 | -2.77 | -10.72 | 2 | 6 | 0 | 57 | 256.35 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.39 | 0.84 | -105.58 | 4 | 6 | 2 | 63 | 258.366 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.39 | -1.42 | -54.25 | 3 | 6 | 1 | 61 | 257.358 | 4 | ↓ |