In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2R)-1-(5-chloro-2-thienyl)-2-(3,3-dimethylmorpholin-4-yl)propan-1-one (2R)-1-(5-chloro-2-thienyl)-2-(3…
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) | 3.18 | 4.43 | -4.56 | 0 | 3 | 0 | 30 | 287.812 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.18 | 6.31 | -33.55 | 1 | 3 | 1 | 31 | 288.82 | 3 | ↓ |