In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 28 | No |
Popular Name: N-[(2S)-2-(diethylamino)-2-phenyl-ethyl]-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide N-[(2S)-2-(diethylamino)-2-pheny…
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) | 3.05 | 11.69 | -64.52 | 3 | 5 | 1 | 54 | 395.552 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.05 | 9.92 | -20.76 | 2 | 5 | 0 | 53 | 394.544 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.