In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 21 | Yes |
Popular Name: [3-[[(2S)-2-ethylmorpholin-4-yl]methyl]-4-fluoro-benzothiophen-2-yl]methanamine [3-[[(2S)-2-ethylmorpholin-4-yl]…
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) | 2.89 | 4.39 | -50.92 | 3 | 3 | 1 | 40 | 309.43 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.89 | 6.62 | -119.48 | 4 | 3 | 2 | 41 | 310.438 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.