In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2011 | 28 | 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) | 2.00 | 4.4 | -20.26 | 0 | 10 | 0 | 117 | 383.364 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 5.51 | -42.71 | 1 | 10 | 1 | 118 | 384.372 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.