In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 29 | No |
None
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) | 3.63 | 9 | -10.88 | 2 | 6 | 0 | 76 | 429.929 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 8.94 | -12.18 | 2 | 6 | 0 | 76 | 429.929 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 6.49 | -12.48 | 2 | 6 | 0 | 80 | 429.929 | 5 | ↓ |