In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2006 | 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) | 1.93 | 6.54 | -19.97 | 1 | 7 | 0 | 78 | 328.372 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 6.73 | -50.98 | 2 | 7 | 1 | 79 | 329.38 | 7 | ↓ |