In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2008 | 20 | No |
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) | -0.87 | -5.2 | -16.93 | 6 | 9 | 0 | 142 | 299.312 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.87 | -4.93 | -49.11 | 7 | 9 | 1 | 144 | 300.32 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.87 | -9.3 | -49.91 | 7 | 9 | 1 | 144 | 300.32 | 2 | ↓ |