In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 18 | Yes |
Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(thiazol-2-ylmethyl)methanamine 1-(2,3-dihydro-1,4-benzodioxin-6…
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) | 1.07 | 4.58 | -47.12 | 2 | 4 | 1 | 48 | 263.342 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 3.22 | -9.72 | 1 | 4 | 0 | 43 | 262.334 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.