In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 18 | 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) | 1.43 | 3.25 | -40.55 | 2 | 4 | 1 | 38 | 251.35 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 1.83 | -4.27 | 1 | 4 | 0 | 34 | 250.342 | 6 | ↓ |