In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2010 | 18 | Yes |
Popular Name: 6-(5-chlorothiophene-2-carbonyl)-3H-1,3-benzoxazol-2-one 6-(5-chlorothiophene-2-carbonyl)…
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) | 3.31 | 4.85 | -8.84 | 1 | 4 | 0 | 63 | 279.704 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 2.24 | -40.72 | 0 | 4 | -1 | 66 | 278.696 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.