In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 29 | 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) | 3.80 | 7.94 | -57.24 | 1 | 6 | -1 | 91 | 386.431 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.35 | 9.71 | -15.3 | 2 | 6 | 0 | 88 | 387.439 | 3 | ↓ |