| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 21 | Yes |
Popular Name: (1S)-1-(1,3-dihydroisobenzofuran-5-yl)-N-methyl-1-(3,4,5-trifluorophenyl)methanamine (1S)-1-(1,3-dihydroisobenzofuran…
| 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) | 3.34 | 7.51 | -56.87 | 2 | 2 | 1 | 26 | 294.296 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 6.54 | -6.51 | 1 | 2 | 0 | 21 | 293.288 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
