In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 37 | No |
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) | 2.67 | 5.57 | -63.84 | 1 | 9 | -1 | 127 | 525.603 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 4.82 | -19.94 | 2 | 9 | 0 | 124 | 526.611 | 10 | ↓ |