In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2006 | 26 | 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) | 2.90 | 7.62 | -14.06 | 1 | 5 | 0 | 62 | 349.434 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 8.48 | -33.44 | 2 | 5 | 1 | 63 | 350.442 | 5 | ↓ |