In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 33 | 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) | 3.67 | 11.08 | -78.93 | 1 | 7 | 0 | 83 | 452.551 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 1.36 | -47.05 | 1 | 7 | 1 | 77 | 453.559 | 11 | ↓ |