In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 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) | 2.95 | 11.68 | -73.85 | 1 | 7 | 0 | 82 | 432.524 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 10.86 | -48.96 | 2 | 7 | 1 | 79 | 433.532 | 7 | ↓ |