In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 20 | Yes |
Popular Name: [(1R,5S)-8-methyl-3-(4-propylpiperazin-1-yl)-8-azabicyclo[3.2.1]octan-3-yl]methanamine [(1R,5S)-8-methyl-3-(4-propylpip…
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) | 0.78 | 5.01 | -177.13 | 5 | 4 | 3 | 40 | 283.484 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.78 | 2.68 | -101.08 | 4 | 4 | 2 | 39 | 282.476 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.78 | 1.96 | -34.76 | 3 | 4 | 1 | 37 | 281.468 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.78 | 0.28 | -43.6 | 3 | 4 | 1 | 37 | 281.468 | 4 | ↓ |