In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 18 | Yes |
Popular Name: (1S,2S)-1-[5-(4-chlorophenyl)-1H-imidazol-2-yl]-2-methyl-butan-1-amine (1S,2S)-1-[5-(4-chlorophenyl)-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) | 1.50 | 6.61 | -53.09 | 4 | 3 | 1 | 56 | 264.78 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 6.34 | -6.49 | 3 | 3 | 0 | 55 | 263.772 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 6.38 | -123.61 | 5 | 3 | 2 | 58 | 265.788 | 4 | ↓ |