| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2011 | 15 | Yes |
Popular Name: (2S)-2-methyl-4-[[(3R)-3-methylpyrrolidin-3-yl]methyl]-1,4-oxazepane (2S)-2-methyl-4-[[(3R)-3-methylp…
| 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) | 1.35 | 3.44 | -40.91 | 2 | 3 | 1 | 29 | 213.345 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 4.72 | -102.74 | 3 | 3 | 2 | 30 | 214.353 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
