| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2010 | 20 | Yes |
Popular Name: (1R)-1-(5-chloro-2-thienyl)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-methanamine (1R)-1-(5-chloro-2-thienyl)-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) | 3.75 | 7.75 | -45.33 | 2 | 3 | 1 | 35 | 310.826 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 6.53 | -5.54 | 1 | 3 | 0 | 30 | 309.818 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
