| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 21 | Yes |
Popular Name: 1-[4-[(2-ethylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]-3-methoxy-propan-1-one 1-[4-[(2-ethylthiazol-4-yl)methy…
| 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) | 0.94 | 7.08 | -41.86 | 1 | 5 | 1 | 47 | 312.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.94 | 5.22 | -11.48 | 0 | 5 | 0 | 46 | 311.451 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
