| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 16 | Yes |
Popular Name: (3R)-3-[[(1S)-1-(cyclopropylmethyl)propyl]amino]azepan-2-one (3R)-3-[[(1S)-1-(cyclopropylmeth…
| 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) | 2.10 | 5.14 | -35.35 | 3 | 3 | 1 | 46 | 225.356 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 3.51 | -7.08 | 2 | 3 | 0 | 41 | 224.348 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
