In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 24 | 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) | 1.62 | 8.99 | -34.78 | 1 | 6 | 1 | 64 | 327.408 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 8.61 | -10.11 | 0 | 6 | 0 | 62 | 326.4 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.