In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 14 | Yes |
Popular Name: 1-cyclopropyl-2-[(2S)-2-methyl-1,4-oxazepan-4-yl]ethanone 1-cyclopropyl-2-[(2S)-2-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) | 0.86 | 5.92 | -38.72 | 1 | 3 | 1 | 31 | 198.286 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 3.99 | -6.56 | 0 | 3 | 0 | 30 | 197.278 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.