In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (7R,8S)-7-(4-isopropylpiperazin-1-yl)-N-methyl-1,4-dioxaspiro[4.5]decan-8-amine (7R,8S)-7-(4-isopropylpiperazin-…
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) | 1.22 | 5.09 | -91.71 | 3 | 5 | 2 | 43 | 299.459 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.22 | 2.87 | -35.94 | 2 | 5 | 1 | 42 | 298.451 | 3 | ↓ |