In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 24 | 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) | -3.45 | -1.52 | -223.75 | 2 | 13 | -3 | 201 | 382.138 | 4 | ↓ |
Mid Mid (pH 6-8) | -3.45 | -2.68 | -116.79 | 3 | 13 | -2 | 198 | 383.146 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.