In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2007 | 28 | 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) | 2.67 | 9.11 | -53.26 | 0 | 6 | -1 | 86 | 394.407 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 8.29 | -15.5 | 1 | 6 | 0 | 83 | 395.415 | 4 | ↓ |