In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2007 | 24 | 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) | 4.71 | -0.81 | -10.47 | 1 | 4 | 0 | 51 | 340.448 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.71 | -0.77 | -32.98 | 2 | 4 | 1 | 52 | 341.456 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.