In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 32 | 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) | 0.83 | 3.23 | -19.58 | 3 | 10 | 0 | 131 | 478.6 | 9 | ↓ |
Lo Low (pH 4.5-6) | 0.83 | 4.37 | -41.02 | 4 | 10 | 1 | 132 | 479.608 | 9 | ↓ |