In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 27 | 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) | 1.20 | 8.6 | -51.56 | 2 | 8 | 1 | 82 | 370.433 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.20 | 6.37 | -20.68 | 1 | 8 | 0 | 81 | 369.425 | 7 | ↓ |