In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2011 | 28 | No |
None
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) | 1.18 | 5.21 | -42.79 | 0 | 10 | -1 | 133 | 387.372 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.72 | 7.68 | -12.36 | 1 | 10 | 0 | 130 | 388.38 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.