In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2008 | 11 | 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) | 0.42 | -1.19 | -5.46 | 0 | 3 | 0 | 31 | 151.165 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.42 | -1.08 | -31.86 | 1 | 3 | 1 | 33 | 152.173 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.