In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 17 | Yes |
Popular Name: (1S,2S)-1-(4-ethylphenyl)-2-imidazol-1-yl-propan-1-amine (1S,2S)-1-(4-ethylphenyl)-2-imid…
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) | 0.39 | 8.44 | -111.16 | 4 | 3 | 2 | 47 | 231.343 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.39 | 7.37 | -5.53 | 2 | 3 | 0 | 44 | 229.327 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.39 | 7.74 | -47.69 | 3 | 3 | 1 | 45 | 230.335 | 4 | ↓ |