| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 16 | Yes |
Popular Name: (1R,2S)-N1-(2-dimethylaminoethyl)-N1-isobutyl-cyclopentane-1,2-diamine (1R,2S)-N1-(2-dimethylaminoethyl…
| 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) | 1.25 | 4.58 | -27.53 | 3 | 3 | 1 | 34 | 228.404 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 3.9 | -36.73 | 3 | 3 | 1 | 34 | 228.404 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 7.25 | -226.39 | 5 | 3 | 3 | 37 | 230.42 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 6.41 | -94.1 | 4 | 3 | 2 | 35 | 229.412 | 6 | ↓ |
