| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | Yes |
Popular Name: (3R)-6-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-3-(ethylamino)indolin-2-one (3R)-6-[(3S)-3-(dimethylamino)py…
| 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) | 1.27 | 5.61 | -85.89 | 4 | 5 | 2 | 53 | 290.411 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 1.96 | -5.24 | 2 | 5 | 0 | 48 | 288.395 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 4.36 | -43.81 | 3 | 5 | 1 | 49 | 289.403 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 3.21 | -36.99 | 3 | 5 | 1 | 52 | 289.403 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
