In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | 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) | 5.82 | 10.18 | -9.18 | 0 | 2 | 0 | 40 | 279.359 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.63 | 13.01 | -16.66 | 0 | 2 | 0 | 34 | 280.367 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.