In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 36 | 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) | 4.32 | 16.22 | -14.9 | 0 | 7 | 0 | 62 | 483.616 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.32 | 16.45 | -35.63 | 1 | 7 | 1 | 63 | 484.624 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.32 | 16.44 | -36.92 | 1 | 7 | 1 | 63 | 484.624 | 4 | ↓ |