In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 15 | 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) | 0.17 | 1.43 | -46.76 | 2 | 5 | 1 | 57 | 236.361 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.17 | 0.25 | -7.96 | 1 | 5 | 0 | 53 | 235.353 | 4 | ↓ |