| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(1R,5S)-8…
| 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) | 2.01 | 5.08 | -28.79 | 2 | 3 | 1 | 23 | 254.442 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 9.04 | -80.95 | 3 | 3 | 2 | 21 | 255.45 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 6.86 | -28.69 | 2 | 3 | 1 | 20 | 254.442 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 6.29 | -102.39 | 3 | 3 | 2 | 24 | 255.45 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.43 | -92.67 | 3 | 3 | 2 | 24 | 255.45 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.01 | 8.74 | -186.8 | 4 | 3 | 3 | 25 | 256.458 | 6 | ↓ |
