In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2010 | 27 | 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) | 0.86 | 1.15 | -29.12 | 1 | 8 | 0 | 131 | 401.346 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 1.06 | -23.85 | 2 | 8 | 0 | 128 | 402.354 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.