In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 27 | Yes |
None
None
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) | -0.86 | -1.67 | -27.45 | 3 | 10 | 0 | 112 | 377.449 | 9 | ↓ |
Lo Low (pH 4.5-6) | -0.86 | 0.54 | -55.17 | 4 | 10 | 1 | 113 | 378.457 | 9 | ↓ |