| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 18 | Yes |
Popular Name: (1R,2S)-N1-butyl-N1-[(1S)-1-methylpropyl]-N2-propyl-cyclopentane-1,2-diamine (1R,2S)-N1-butyl-N1-[(1S)-1-meth…
| 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) | 4.53 | 10.72 | -102.83 | 3 | 2 | 2 | 21 | 256.478 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.53 | 8.66 | -27.13 | 2 | 2 | 1 | 16 | 255.47 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.53 | 8.61 | -30.9 | 2 | 2 | 1 | 20 | 255.47 | 9 | ↓ |
