In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2008 | 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) | 1.21 | -3.58 | -26.29 | 2 | 8 | 0 | 101 | 363.377 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 6.38 | -43.35 | 3 | 8 | 1 | 103 | 364.385 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.