In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 21 | 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) | 4.16 | 6.91 | -41 | 3 | 3 | 1 | 46 | 311.808 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.16 | 5.64 | -8.85 | 2 | 3 | 0 | 41 | 310.8 | 3 | ↓ |