| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 19 | Yes |
Popular Name: 4-[[(3S)-3-methyl-3-piperidyl]methyl]-3,5-dihydro-2H-1,4-benzoxazepine 4-[[(3S)-3-methyl-3-piperidyl]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) | 2.06 | 5.87 | -42.44 | 2 | 3 | 1 | 29 | 261.389 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.06 | 7.27 | -107.26 | 3 | 3 | 2 | 30 | 262.397 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
