In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 18 | Yes |
Popular Name: 1-[(2R)-2,3-dihydro-1,4-benzodioxin-2-yl]-N-(thiazol-5-ylmethyl)methanamine 1-[(2R)-2,3-dihydro-1,4-benzodio…
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) | 1.81 | 3.5 | -8.51 | 1 | 4 | 0 | 43 | 262.334 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 4.87 | -49.48 | 2 | 4 | 1 | 48 | 263.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.