In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 30 | Yes |
Popular Name: 8-(dimethylaminomethyl)-7-hydroxy-3-(4-isopropylphenoxy)-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) | 5.84 | 11.42 | -30 | 1 | 5 | 0 | 67 | 421.415 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.84 | 8.89 | -35.77 | 0 | 5 | -1 | 66 | 420.407 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.84 | 8.33 | -8.34 | 1 | 5 | 0 | 63 | 421.415 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.84 | 10.96 | -51.09 | 2 | 5 | 1 | 64 | 422.423 | 6 | ↓ |