In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 18 | Yes |
Popular Name: (2S)-1-(5-chloro-2-thienyl)-2-[(3S)-3-ethylmorpholin-4-yl]propan-1-one (2S)-1-(5-chloro-2-thienyl)-2-[(…
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) | 3.23 | 4.94 | -4.9 | 0 | 3 | 0 | 30 | 287.812 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 7.02 | -32.13 | 1 | 3 | 1 | 31 | 288.82 | 4 | ↓ |