| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 20 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(ethylamino)-3-[methyl-[(3R)-1-methyl-3-piperidyl]amino]propanamide (2S)-2-cyclopropyl-2-(ethylamino…
| 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 | 3 | -93.81 | 5 | 5 | 2 | 67 | 284.448 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.58 | 3.26 | -36.75 | 4 | 5 | 1 | 63 | 283.44 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.58 | 0.93 | -5.73 | 3 | 5 | 0 | 62 | 282.432 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.58 | 3.5 | -38.36 | 4 | 5 | 1 | 63 | 283.44 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
