In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 34 | 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) | 6.70 | 15.62 | -15 | 0 | 5 | 0 | 46 | 456.586 | 10 | ↓ |
Lo Low (pH 4.5-6) | 6.70 | 16.27 | -33.94 | 1 | 5 | 1 | 47 | 457.594 | 10 | ↓ |