In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2007 | 25 | 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) | 4.99 | 11.15 | -16.01 | 0 | 4 | 0 | 44 | 330.435 | 1 | ↓ |
Lo Low (pH 4.5-6) | 4.99 | 11.56 | -25.4 | 1 | 4 | 1 | 46 | 331.443 | 1 | ↓ |