In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2008 | 15 | No |
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) | -0.59 | 3.02 | -21.86 | 2 | 5 | 0 | 66 | 219.273 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.59 | 3.3 | -60.13 | 3 | 5 | 1 | 68 | 220.281 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.