| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: (1S)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-(4-methylthiazol-5-yl)ethanamine (1S)-N-[[(3R)-2,3-dihydro-1,4-be…
| 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) | 2.59 | 5.87 | -46.99 | 2 | 4 | 1 | 48 | 291.396 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 4.62 | -8.71 | 1 | 4 | 0 | 43 | 290.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
