In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 16 | Yes |
Popular Name: (2S)-2-(2-diethylaminoethylamino)-2-(2-thienyl)acetonitrile (2S)-2-(2-diethylaminoethylamino…
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) | 2.15 | 6.02 | -39.07 | 2 | 3 | 1 | 40 | 238.38 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 3.87 | -5.03 | 1 | 3 | 0 | 39 | 237.372 | 7 | ↓ |