In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 13 | Yes |
Popular Name: {1-[4-(2-thienyl)-1H-imidazol-2-yl]ethyl}amine dihydrochloride {1-[4-(2-thienyl)-1H-imidazol-2-…
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) | -0.65 | 2.76 | -53.24 | 4 | 3 | 1 | 56 | 194.283 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.65 | 2.43 | -7.34 | 3 | 3 | 0 | 55 | 193.275 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.65 | 2.38 | -5.47 | 3 | 3 | 0 | 55 | 193.275 | 2 | ↓ |