| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 21 | Yes |
Popular Name: 2-[4-[(2S)-3-amino-2-methyl-propyl]piperazin-1-yl]-1-(4-methylpiperazin-1-yl)ethanone 2-[4-[(2S)-3-amino-2-methyl-prop…
| 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) | -0.97 | 1.82 | -92.58 | 4 | 6 | 2 | 59 | 299.463 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.97 | 1.99 | -91.59 | 4 | 6 | 2 | 59 | 299.463 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.97 | 1.62 | -106.24 | 4 | 6 | 2 | 59 | 299.463 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.97 | 3.98 | -163.02 | 5 | 6 | 3 | 60 | 300.471 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.97 | -0.36 | -47.05 | 3 | 6 | 1 | 58 | 298.455 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.97 | 4.17 | -158.33 | 5 | 6 | 3 | 60 | 300.471 | 5 | ↓ |
