In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 20 | Yes |
Popular Name: 2-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]-1-(4-propylphenyl)ethanone 2-[methyl-[[(2S)-tetrahydrofuran…
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) | 3.17 | 9.72 | -39.28 | 1 | 3 | 1 | 31 | 276.4 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 7.38 | -9.2 | 0 | 3 | 0 | 30 | 275.392 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.