| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 18 | Yes |
Popular Name: (2S)-N-[(1R)-1-(2,5-dimethyl-3-furyl)ethyl]-N',N',3-trimethyl-butane-1,2-diamine (2S)-N-[(1R)-1-(2,5-dimethyl-3-f…
| 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) | 2.58 | 7.58 | -33.31 | 2 | 3 | 1 | 30 | 253.41 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 6.54 | -3.11 | 1 | 3 | 0 | 28 | 252.402 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 6.55 | -36.09 | 2 | 3 | 1 | 33 | 253.41 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 8.55 | -119.37 | 3 | 3 | 2 | 34 | 254.418 | 6 | ↓ |
