In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 23 | Yes |
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) | 3.43 | 9.17 | -11.47 | 2 | 4 | 0 | 53 | 309.413 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.43 | 9.46 | -29.94 | 3 | 4 | 1 | 54 | 310.421 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.