In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 36 | 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) | 3.23 | 8.07 | -56.95 | 0 | 8 | -1 | 91 | 513.998 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 10.4 | -70.89 | 1 | 8 | 0 | 93 | 515.006 | 10 | ↓ |