In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 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) | 1.26 | 2.76 | -13.36 | 3 | 4 | 0 | 68 | 241.294 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 3.2 | -44.71 | 4 | 4 | 1 | 69 | 242.302 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.