In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 19 | Yes |
Popular Name: (1R)-1-(4-tert-butylphenyl)-2-(2-methylimidazol-1-yl)ethanamine (1R)-1-(4-tert-butylphenyl)-2-(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) | 0.90 | 8.53 | -109.46 | 4 | 3 | 2 | 47 | 259.397 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.90 | 7.66 | -7.5 | 2 | 3 | 0 | 44 | 257.381 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 8.11 | -52.34 | 3 | 3 | 1 | 45 | 258.389 | 4 | ↓ |