In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 18 | 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) | 0.20 | 6.65 | -50.64 | 0 | 5 | -1 | 73 | 247.274 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.20 | 4.68 | -11.42 | 1 | 5 | 0 | 71 | 248.282 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.