In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2005 | 19 | No |
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) | 2.11 | 9.68 | -23.09 | 0 | 3 | 0 | 51 | 254.285 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.69 | 9.77 | -52.56 | 0 | 3 | -1 | 57 | 253.277 | 3 | ↓ |