In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 23 | Yes |
Popular Name: 2-methoxy-N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-N-(2-thienylmethyl)ethanamine 2-methoxy-N-[(7-methoxy-1,3-benz…
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) | 2.70 | 4.73 | -10.23 | 0 | 5 | 0 | 40 | 335.425 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 6.96 | -45.09 | 1 | 5 | 1 | 41 | 336.433 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.