In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: N-[3-(4-methylpiperazin-1-yl)propyl]-1,4-dioxaspiro[4.5]decan-8-amine N-[3-(4-methylpiperazin-1-yl)pro…
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) | 1.10 | 5.19 | -90.82 | 3 | 5 | 2 | 43 | 299.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 5.06 | -110.9 | 3 | 5 | 2 | 43 | 299.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 2.72 | -43.06 | 2 | 5 | 1 | 42 | 298.451 | 5 | ↓ |