In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: N-[2-[[(2S)-3-(2-bromo-4-methyl-phenoxy)-2-hydroxy-propyl]amino]ethyl]acetamide N-[2-[[(2S)-3-(2-bromo-4-methyl-…
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) | 1.12 | 2.29 | -56.15 | 4 | 5 | 1 | 75 | 346.245 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.12 | 0.9 | -14.84 | 3 | 5 | 0 | 71 | 345.237 | 8 | ↓ |