In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2008 | 29 | Yes |
Popular Name: 8-(dimethylaminomethyl)-7-hydroxy-3-(4-methoxyphenoxy)-2-(trifluoromethyl)chromen-4-one 8-(dimethylaminomethyl)-7-hydrox…
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) | 4.39 | 8.78 | -30.73 | 1 | 6 | 0 | 76 | 409.36 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.39 | 6.28 | -36.67 | 0 | 6 | -1 | 75 | 408.352 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 7.99 | -47.66 | 2 | 6 | 1 | 73 | 410.368 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 5.71 | -9.36 | 1 | 6 | 0 | 72 | 409.36 | 6 | ↓ |