In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | Yes |
Popular Name: (1S)-1-[5-(4-isopropylphenyl)-1H-imidazol-2-yl]-3-methyl-butan-1-amine (1S)-1-[5-(4-isopropylphenyl)-1H…
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) | 2.36 | 7.57 | -51.07 | 4 | 3 | 1 | 56 | 272.416 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.36 | 7.29 | -6.98 | 3 | 3 | 0 | 55 | 271.408 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 7.91 | -119.69 | 5 | 3 | 2 | 58 | 273.424 | 5 | ↓ |