In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2005 | 16 | 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) | -1.94 | -6.54 | -9.58 | 3 | 6 | 0 | 91 | 223.232 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.94 | -6.43 | -39.59 | 4 | 6 | 1 | 92 | 224.24 | 5 | ↓ |