In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 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) | 1.86 | 3.61 | -43.46 | 1 | 6 | -1 | 78 | 240.246 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.86 | 3.7 | -10 | 2 | 6 | 0 | 80 | 241.254 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.