In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 17 | 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) | 0.42 | 9.66 | -50.36 | 2 | 5 | 1 | 41 | 254.383 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.42 | 8.12 | -10.63 | 1 | 5 | 0 | 40 | 253.375 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.