In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 23 | Yes |
Popular Name: 3-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazin-1-yl]-9-azaspiro[5.5]undecane 3-[4-[[(2S)-tetrahydrofuran-2-yl…
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) | 1.45 | 6.31 | -89.13 | 3 | 4 | 2 | 34 | 323.525 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.45 | 3.91 | -41.11 | 2 | 4 | 1 | 32 | 322.517 | 3 | ↓ |