In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2010 | 16 | 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) | 2.74 | 8.13 | -9.09 | 0 | 2 | 0 | 30 | 217.312 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.74 | 8.58 | -34.01 | 1 | 2 | 1 | 31 | 218.32 | 4 | ↓ |