In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 18 | Yes |
Popular Name: [(1R,5S)-8-methyl-3-(4-methylpiperazin-1-yl)-8-azabicyclo[3.2.1]octan-3-yl]methanamine [(1R,5S)-8-methyl-3-(4-methylpip…
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) | -0.09 | 3.59 | -174.38 | 5 | 4 | 3 | 40 | 255.43 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.09 | 0.44 | -35.1 | 3 | 4 | 1 | 37 | 253.414 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.09 | 3.58 | -182.98 | 5 | 4 | 3 | 40 | 255.43 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.09 | 1.11 | -100.81 | 4 | 4 | 2 | 39 | 254.422 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.09 | 1.23 | -101.32 | 4 | 4 | 2 | 39 | 254.422 | 2 | ↓ |