In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 18 | 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) | 4.00 | 5.81 | -6.76 | 2 | 3 | 0 | 52 | 262.74 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.00 | 5.74 | -25.15 | 3 | 3 | 1 | 53 | 263.748 | 2 | ↓ |