| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2011 | 17 | Yes |
Popular Name: N-[[(2S,4S)-4-methoxypyrrolidin-2-yl]methyl]-N-methyl-1-(1-methylimidazol-2-yl)methanamine N-[[(2S,4S)-4-methoxypyrrolidin-…
| 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) | -0.22 | 3.17 | -91.05 | 3 | 5 | 2 | 48 | 240.351 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.22 | 2.95 | -45.79 | 2 | 5 | 1 | 47 | 239.343 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.22 | 1.39 | -8.46 | 1 | 5 | 0 | 42 | 238.335 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.22 | 1.59 | -30.16 | 2 | 5 | 1 | 44 | 239.343 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
