In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 35 | Yes |
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) | 4.97 | 9.05 | -51.82 | 2 | 7 | 1 | 76 | 506.574 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 6.81 | -10.94 | 1 | 7 | 0 | 74 | 505.566 | 8 | ↓ |