In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 20 | Yes |
Popular Name: (3R)-N-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]-2,3-dihydrobenzofuran-3-amine (3R)-N-[(1S)-1-(3-chloro-4-fluor…
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) | 4.28 | 8.34 | -48.22 | 2 | 2 | 1 | 26 | 292.761 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 7.44 | -5.47 | 1 | 2 | 0 | 21 | 291.753 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.