In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 33 | 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) | 1.02 | 8.13 | -78.48 | 1 | 9 | 0 | 105 | 455.511 | 10 | ↓ |
Lo Low (pH 4.5-6) | 1.02 | 7.31 | -60.5 | 2 | 9 | 1 | 103 | 456.519 | 10 | ↓ |