In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2011 | 31 | Yes |
Popular Name: (5R)-2-amino-3-methyl-5-[1-(2-methylpropanoyl)-4-piperidyl]-5-(3-phenylphenyl)imidazol-4-one (5R)-2-amino-3-methyl-5-[1-(2-me…
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) | 3.52 | 12.75 | -45.44 | 3 | 6 | 1 | 81 | 419.549 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.65 | 12.73 | -47.16 | 3 | 6 | 1 | 78 | 419.549 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.65 | 12.75 | -13.71 | 2 | 6 | 0 | 76 | 418.541 | 4 | ↓ |