In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2010 | 19 | 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 | 3.49 | -9.74 | 0 | 4 | 0 | 41 | 298.795 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 5.73 | -42.79 | 1 | 4 | 1 | 42 | 299.803 | 3 | ↓ |