In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2010 | 22 | 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) | 6.07 | 11.36 | -8.09 | 0 | 2 | 0 | 18 | 333.262 | 5 | ↓ |
Lo Low (pH 4.5-6) | 6.07 | 11.84 | -23.32 | 1 | 2 | 1 | 19 | 334.27 | 5 | ↓ |