| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 21 | Yes |
Popular Name: (2R)-2-cyclopropyl-2-(isopropylamino)-3-[methyl-[(3R)-1-methyl-3-piperidyl]amino]propanoic (2R)-2-cyclopropyl-2-(isopropyla…
| 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) | -0.58 | 6.51 | -58.24 | 3 | 5 | 1 | 64 | 298.451 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.58 | 4.43 | -28.23 | 2 | 5 | 0 | 63 | 297.443 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.58 | 7.3 | -59.89 | 3 | 5 | 1 | 64 | 298.451 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -0.58 | 8.89 | -132.01 | 4 | 5 | 2 | 66 | 299.459 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
