In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 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) | 0.23 | 2.73 | -90.49 | 5 | 4 | 2 | 62 | 252.358 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.23 | 0.53 | -48.16 | 4 | 4 | 1 | 60 | 251.35 | 5 | ↓ |