In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 21 | Yes |
Popular Name: (2S)-2-(2-diethylaminoethylamino)-2-(4-hydroxy-3,5-dimethyl-phenyl)acetamide (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) | 1.73 | 2.3 | -36.71 | 5 | 5 | 1 | 80 | 294.419 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 0.17 | -9.17 | 4 | 5 | 0 | 79 | 293.411 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 1.24 | -40.3 | 5 | 5 | 1 | 83 | 294.419 | 8 | ↓ |