| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 16 | Yes |
Popular Name: (2R)-1-(cyclopropylamino)-3-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]propan-2-ol (2R)-1-(cyclopropylamino)-3-[(3S…
| 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) | 0.00 | 1.99 | -81.09 | 4 | 4 | 2 | 45 | 229.368 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | -0.39 | -36.58 | 3 | 4 | 1 | 43 | 228.36 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | 2.04 | -101.09 | 4 | 4 | 2 | 45 | 229.368 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.00 | 4.43 | -182.94 | 5 | 4 | 3 | 46 | 230.376 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
