In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2005 | 30 | No |
Popular Name: N-butyl-4-[4-(4-phenylphenyl)-1H-imidazol-2-yl]-piperidine-1-carbothioamide N-butyl-4-[4-(4-phenylphenyl)-1H…
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) | 5.53 | 14.77 | -50.26 | 3 | 4 | 1 | 45 | 419.618 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.53 | -2.42 | -18.17 | 2 | 4 | 0 | 43 | 418.61 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.53 | 14.34 | -16.87 | 2 | 4 | 0 | 44 | 418.61 | 8 | ↓ |