In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 35 | 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) | 5.25 | 9.26 | -47.82 | 0 | 7 | -1 | 93 | 510.353 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.80 | 11.91 | -11.3 | 1 | 7 | 0 | 90 | 511.361 | 6 | ↓ |