In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | Yes |
Popular Name: 4-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]butanoic 4-[methyl-[2-(2-methylimidazol-1…
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) | -0.10 | 7.93 | -64.93 | 1 | 5 | 0 | 62 | 225.292 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.10 | 5.63 | -46.85 | 0 | 5 | -1 | 61 | 224.284 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.10 | 8.41 | -103.09 | 2 | 5 | 1 | 64 | 226.3 | 7 | ↓ |