In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2011 | 32 | Yes |
Popular Name: 2-[5-(1-adamantyl)-1,2,4-oxadiazol-3-yl]-5-methyl-benzo[b][1,4]benzothiazepin-6-one 2-[5-(1-adamantyl)-1,2,4-oxadiaz…
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) | 6.62 | 12.1 | -11.1 | 0 | 5 | 0 | 61 | 443.572 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.