In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 10th, 2011 | 24 | No |
Popular Name: C12072; Gardneral C12072; Gardneral
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) | 3.76 | 5.85 | -8.04 | 1 | 4 | 0 | 45 | 322.408 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.76 | 8.14 | -47.6 | 2 | 4 | 1 | 47 | 323.416 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.