| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: 3-(cyclopropylamino)-1-[(3S)-3-(diethylamino)pyrrolidin-1-yl]propan-1-one 3-(cyclopropylamino)-1-[(3S)-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) | 0.99 | 6.6 | -87.75 | 3 | 4 | 2 | 41 | 255.406 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 4.48 | -42.18 | 2 | 4 | 1 | 40 | 254.398 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
