In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 19 | Yes |
Popular Name: N-[[1-[(1-ethylimidazol-2-yl)methyl]imidazol-2-yl]methyl]-2-methyl-propan-2-amine N-[[1-[(1-ethylimidazol-2-yl)met…
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) | 0.98 | 7.78 | -34.81 | 2 | 5 | 1 | 52 | 262.381 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 6.55 | -10.82 | 1 | 5 | 0 | 48 | 261.373 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.98 | 7.5 | -94.08 | 3 | 5 | 2 | 54 | 263.389 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.