In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2011 | 27 | 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) | -0.84 | 4.86 | -16.48 | 1 | 10 | 0 | 121 | 370.369 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.66 | 3.96 | -43.12 | 0 | 10 | -1 | 127 | 369.361 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.