In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 24 | 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) | 2.40 | 7.02 | -18.67 | 1 | 6 | 0 | 72 | 365.459 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.40 | 8.16 | -39.75 | 2 | 6 | 1 | 74 | 366.467 | 4 | ↓ |