In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 24 | 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) | 1.72 | 10.37 | -8.77 | 0 | 9 | 0 | 76 | 336.396 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.72 | 10.59 | -27.52 | 1 | 9 | 1 | 77 | 337.404 | 3 | ↓ |