| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: N-[[(2S,3S)-1-methyl-2-(1-methylpyrazol-4-yl)pyrrolidin-3-yl]methyl]ethanamine N-[[(2S,3S)-1-methyl-2-(1-methyl…
| 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) | 0.61 | 3.34 | -38.47 | 2 | 4 | 1 | 38 | 223.344 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 5.6 | -98.02 | 3 | 4 | 2 | 39 | 224.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
