| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 18 | Yes |
Popular Name: (3R)-3-[[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]amino]azepan-2-one (3R)-3-[[(1S)-1-(2,4-dimethylthi…
| 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) | 1.16 | 3.88 | -41.08 | 3 | 4 | 1 | 59 | 268.406 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 3.57 | -9.29 | 2 | 4 | 0 | 54 | 267.398 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
