In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 28 | 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) | 2.49 | 9.25 | -17.89 | 1 | 6 | 0 | 59 | 398.894 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.49 | 11.53 | -56.99 | 2 | 6 | 1 | 60 | 399.902 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.