In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 25 | Yes |
Popular Name: (3S)-1-keto-3-methyl-N-[2-(trifluoromethyl)phenyl]isochroman-3-carboxamide (3S)-1-keto-3-methyl-N-[2-(trifl…
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) | 3.85 | 3.21 | -11.17 | 1 | 4 | 0 | 55 | 349.308 | 3 | ↓ |