In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2010 | 24 | 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) | 3.09 | 6.64 | -9.7 | 0 | 4 | 0 | 41 | 348.443 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.09 | 8.85 | -50.45 | 1 | 4 | 1 | 42 | 349.451 | 5 | ↓ |