In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 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) | 0.97 | 2.95 | -96.65 | 5 | 3 | 2 | 56 | 171.288 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.94 | 3.74 | -24.89 | 5 | 3 | 1 | 56 | 170.28 | 4 | ↓ |