In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 30 | 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) | 1.10 | 1.3 | -17.2 | 2 | 9 | 0 | 102 | 417.462 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 3.5 | -59.32 | 3 | 9 | 1 | 103 | 418.47 | 9 | ↓ |