In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 18 | Yes |
Popular Name: N-(4,5-dihydrothieno[3,2-e][1,3]benzothiazol-2-ylmethyl)-2-methoxy-ethanamine N-(4,5-dihydrothieno[3,2-e][1,3]…
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) | 2.10 | 5.43 | -40.39 | 2 | 3 | 1 | 39 | 281.426 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 4.08 | -8.84 | 1 | 3 | 0 | 34 | 280.418 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.