In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2010 | 19 | 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) | 3.42 | 6.65 | -24.89 | 4 | 3 | 1 | 52 | 254.288 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 6.34 | -12.61 | 3 | 3 | 0 | 51 | 253.28 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.