In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2004 | 24 | Yes |
Popular Name: (3S)-1-keto-N-[4-(trifluoromethyl)phenyl]isochroman-3-carboxamide (3S)-1-keto-N-[4-(trifluoromethy…
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) | 3.45 | 2.83 | -19.59 | 1 | 4 | 0 | 55 | 335.281 | 3 | ↓ |