| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 20 | Yes |
Popular Name: (1S,2S)-2-(4-methylpiperazin-1-yl)cyclododecan-1-amine (1S,2S)-2-(4-methylpiperazin-1-y…
| 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) | 3.53 | 7.63 | -103.1 | 4 | 3 | 2 | 35 | 283.504 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 5.17 | -41.11 | 3 | 3 | 1 | 34 | 282.496 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 7.02 | -127.83 | 4 | 3 | 2 | 35 | 283.504 | 1 | ↓ |
