In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 25 | Yes |
Popular Name: (1R)-N-[(3-allyl-4-allyloxy-phenyl)methyl]-1-imidazo[2,1-b][1,3,4]thiadiazol-6-yl-ethanamine (1R)-N-[(3-allyl-4-allyloxy-phen…
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) | 3.91 | 9.74 | -44.78 | 2 | 5 | 1 | 56 | 355.487 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 8.53 | -13.42 | 1 | 5 | 0 | 51 | 354.479 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.