In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 16 | 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) | 0.59 | 1.36 | -33.98 | 4 | 4 | 1 | 64 | 220.296 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.59 | 1.45 | -5.99 | 3 | 4 | 0 | 62 | 219.288 | 2 | ↓ |