In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2009 | 27 | 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) | 3.00 | 10.09 | -39.22 | 2 | 5 | 1 | 44 | 369.485 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 10.76 | -137.8 | 3 | 5 | 2 | 49 | 370.493 | 7 | ↓ |