In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 12 | 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) | 1.41 | 4.46 | -94.56 | 5 | 3 | 2 | 56 | 173.304 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.76 | 4.4 | -32.91 | 5 | 3 | 1 | 56 | 172.296 | 7 | ↓ |