| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 15 | Yes |
Popular Name: (2S,4S)-N-[(5-bromo-2-thienyl)methyl]-2-methyl-tetrahydropyran-4-amine (2S,4S)-N-[(5-bromo-2-thienyl)me…
| 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) | 3.06 | 5.87 | -44.17 | 2 | 2 | 1 | 26 | 291.234 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 4.67 | -2.96 | 1 | 2 | 0 | 21 | 290.226 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
