In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 18 | Yes |
Popular Name: (1S)-1-[5-(3-fluorophenyl)-1H-imidazol-2-yl]-3-methyl-butan-1-amine (1S)-1-[5-(3-fluorophenyl)-1H-im…
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) | 0.99 | 5.75 | -55.28 | 4 | 3 | 1 | 56 | 248.325 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.99 | 5.44 | -9.17 | 3 | 3 | 0 | 55 | 247.317 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.99 | 6.1 | -123.73 | 5 | 3 | 2 | 58 | 249.333 | 4 | ↓ |