In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 16 | 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) | 1.43 | 3.04 | -12.64 | 3 | 5 | 0 | 73 | 214.228 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 3.15 | -28.52 | 4 | 5 | 1 | 74 | 215.236 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.