In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 19 | Yes |
Popular Name: N-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-1-(2-methylthiazol-4-yl)methanamine N-(2,3-dihydro-1,4-benzodioxin-5…
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) | 1.46 | 5.22 | -40.5 | 2 | 4 | 1 | 48 | 277.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 3.84 | -10.04 | 1 | 4 | 0 | 43 | 276.361 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.