In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 20 | 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) | 3.10 | 7.86 | -10.07 | 1 | 3 | 0 | 49 | 259.312 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 8.3 | -37.91 | 2 | 3 | 1 | 50 | 260.32 | 3 | ↓ |