In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2011 | 29 | No |
None
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) | -3.45 | -8.2 | -77.59 | 6 | 13 | -1 | 210 | 415.379 | 10 | ↓ |
Lo Low (pH 4.5-6) | -3.45 | -10.32 | -35.47 | 7 | 13 | 0 | 207 | 416.387 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.