| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 15 | No |
Popular Name: (3R)-N-[[3-(aminomethyl)isoxazol-5-yl]methyl]-N-methyl-tetrahydrothiophen-3-amine (3R)-N-[[3-(aminomethyl)isoxazol…
| 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) | 0.53 | 3.87 | -105.66 | 4 | 4 | 2 | 58 | 229.349 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.53 | 3.46 | -46.29 | 3 | 4 | 1 | 56 | 228.341 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
