In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2008 | 32 | 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) | 3.24 | 7.18 | -102.49 | 0 | 9 | -2 | 138 | 430.372 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.78 | 9.92 | -57.61 | 1 | 9 | -1 | 134 | 431.38 | 5 | ↓ |