In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2010 | 31 | Yes |
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) | 1.27 | 13.88 | -91.81 | 2 | 6 | 0 | 82 | 423.488 | 3 | ↓ |
Mid Mid (pH 6-8) | -1.48 | 11.85 | -75.12 | 3 | 6 | 1 | 85 | 424.496 | 2 | ↓ |