In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 24 | Yes |
Popular Name: N-[(2R)-2-(2-chlorophenyl)-2-diethylamino-ethyl]-4-ethyl-thiadiazole-5-carboxamide N-[(2R)-2-(2-chlorophenyl)-2-die…
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) | 3.75 | 8.45 | -45.05 | 2 | 5 | 1 | 59 | 367.926 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.75 | 6.9 | -7.35 | 1 | 5 | 0 | 58 | 366.918 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.