| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 21 | Yes |
Popular Name: (5S)-N-methyl-7,8-dipropoxy-1,2,4,5-tetrahydro-3-benzoxepin-5-amine (5S)-N-methyl-7,8-dipropoxy-1,2,…
| 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) | 3.04 | 7.66 | -39.71 | 2 | 4 | 1 | 44 | 294.415 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 7.08 | -5.89 | 1 | 4 | 0 | 40 | 293.407 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
