In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 25 | No |
Popular Name: 2-[ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]amino]-N-[(4-fluorophenyl)methyl]acetamide 2-[ethyl-[2-oxo-2-(2-thienylmeth…
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) | 2.79 | 7.14 | -43.68 | 3 | 5 | 1 | 63 | 364.466 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 5.14 | -13.22 | 2 | 5 | 0 | 61 | 363.458 | 9 | ↓ |