| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 19 | Yes |
Popular Name: (1S)-6,8-diisopropyl-N-methyl-1,2,4,5-tetrahydro-3-benzoxepin-1-amine (1S)-6,8-diisopropyl-N-methyl-1,…
| 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) | 4.11 | 8.13 | -34.5 | 2 | 2 | 1 | 26 | 262.417 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.11 | 6.76 | -2.25 | 1 | 2 | 0 | 21 | 261.409 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
