In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 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) | 2.10 | 6.37 | -41.3 | 4 | 11 | 1 | 142 | 390.472 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.10 | 4.05 | -14.63 | 3 | 11 | 0 | 140 | 389.464 | 8 | ↓ |