| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 16 | Yes |
Popular Name: (3R)-N-ethyl-1-[(5-methylpyrazin-2-yl)methyl]pyrrolidin-3-amine (3R)-N-ethyl-1-[(5-methylpyrazin…
| 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) | 0.78 | 3.47 | -36.59 | 2 | 4 | 1 | 42 | 221.328 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 2.22 | -41.16 | 2 | 4 | 1 | 46 | 221.328 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 1.01 | -5.04 | 1 | 4 | 0 | 41 | 220.32 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.78 | 4.66 | -112.08 | 3 | 4 | 2 | 47 | 222.336 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
