In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 35 | 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) | 2.86 | 8.16 | -15.24 | 1 | 8 | 0 | 78 | 476.577 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.86 | 10.13 | -48.44 | 2 | 8 | 1 | 79 | 477.585 | 8 | ↓ |