In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 16 | Yes |
Popular Name: (2S)-2-(4-chlorophenyl)-2-(2-methylimidazol-1-yl)ethanamine (2S)-2-(4-chlorophenyl)-2-(2-met…
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) | 1.15 | 6.27 | -113.85 | 4 | 3 | 2 | 47 | 237.734 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.15 | 5.2 | -8.34 | 2 | 3 | 0 | 44 | 235.718 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.15 | 5.8 | -55.54 | 3 | 3 | 1 | 45 | 236.726 | 3 | ↓ |