| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-1-[(3R)-3-(diethylamino)pyrrolidin-1-yl]propan-1-one (2S)-2-amino-2-cyclopropyl-1-[(3…
| 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) | 1.28 | 4.38 | -86.4 | 4 | 4 | 2 | 52 | 255.406 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 4.1 | -39.78 | 3 | 4 | 1 | 51 | 254.398 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 2.08 | -6.65 | 2 | 4 | 0 | 50 | 253.39 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
