In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 30 | Yes |
Popular Name: 7-hydroxy-8-[[(3S)-3-methyl-1-piperidyl]methyl]-3-phenyl-2-(trifluoromethyl)chromen-4-one 7-hydroxy-8-[[(3S)-3-methyl-1-pi…
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) | 5.52 | 10.96 | -42.31 | 2 | 4 | 1 | 55 | 418.435 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.52 | 11.76 | -25.7 | 1 | 4 | 0 | 58 | 417.427 | 4 | ↓ |