In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 15 | No |
Popular Name: (3R,4S)-4-(4-methylpiperazin-1-yl)-1,1-dioxo-thiolan-3-ol (3R,4S)-4-(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) | -1.16 | -1.75 | -45.59 | 2 | 5 | 1 | 62 | 235.329 | 1 | ↓ |
Mid Mid (pH 6-8) | -1.16 | -4.13 | -11.91 | 1 | 5 | 0 | 61 | 234.321 | 1 | ↓ |