In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 19 | No |
Popular Name: 8-acetyl-5,7-dihydroxy-2,2-dimethyl-chromane-6-carbaldehyde 8-acetyl-5,7-dihydroxy-2,2-dimet…
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) | 2.32 | 4.01 | -14.2 | 2 | 5 | 0 | 84 | 264.277 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 3.39 | -39.7 | 1 | 5 | -1 | 87 | 263.269 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 4.41 | -120.16 | 0 | 5 | -2 | 89 | 262.261 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 4.95 | -47.99 | 1 | 5 | -1 | 87 | 263.269 | 2 | ↓ |