| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 19 | Yes |
Popular Name: 2-[4-[(2S)-3-amino-2-methyl-propyl]piperazin-1-yl]-N-cyclopropyl-N-methyl-acetamide 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) | -0.50 | 3.78 | -91.17 | 4 | 5 | 2 | 56 | 270.421 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.50 | 1.2 | -8.72 | 2 | 5 | 0 | 53 | 268.405 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.50 | 1.58 | -47.22 | 3 | 5 | 1 | 54 | 269.413 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.50 | 3.57 | -105.63 | 4 | 5 | 2 | 56 | 270.421 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
