In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 20 | 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) | 2.15 | 4.79 | -66.43 | 2 | 4 | 0 | 65 | 290.388 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 4.19 | -49.91 | 3 | 4 | 1 | 63 | 291.396 | 3 | ↓ |