In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2S)-2-imidazol-1-yl-1-phenyl-N-propyl-butan-1-amine (1S,2S)-2-imidazol-1-yl-1-phenyl…
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) | 3.11 | 10.7 | -40.41 | 2 | 3 | 1 | 34 | 258.389 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.10 | 9.02 | -4.08 | 1 | 3 | 0 | 30 | 257.381 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 11.39 | -105.09 | 3 | 3 | 2 | 36 | 259.397 | 7 | ↓ |