In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 14 | Yes |
Popular Name: (2R,3R)-3-(2-methylimidazol-1-yl)-N-propyl-butan-2-amine (2R,3R)-3-(2-methylimidazol-1-yl…
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) | 1.44 | 7.13 | -92.92 | 3 | 3 | 2 | 36 | 197.326 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 6.66 | -40.56 | 2 | 3 | 1 | 34 | 196.318 | 5 | ↓ |