| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 18 | Yes |
Popular Name: 2-methyl-N-[[5-[[(2S)-2-methylpyrrolidin-1-yl]methyl]isoxazol-3-yl]methyl]propan-2-amine 2-methyl-N-[[5-[[(2S)-2-methylpy…
| 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) | 2.18 | 7.05 | -90.12 | 3 | 4 | 2 | 47 | 253.39 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 5.82 | -37.8 | 2 | 4 | 1 | 42 | 252.382 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
