In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 20 | 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) | 1.20 | 4.1 | -11.04 | 0 | 5 | 0 | 52 | 274.32 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 6.44 | -49.88 | 1 | 5 | 1 | 53 | 275.328 | 3 | ↓ |