In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 19 | Yes |
Popular Name: 1-[2-[(2S)-2-hydroxy-3-[[(1R)-1-methylpropyl]amino]propoxy]phenyl]ethanone 1-[2-[(2S)-2-hydroxy-3-[[(1R)-1-…
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) | 2.19 | 5.58 | -43.46 | 3 | 4 | 1 | 63 | 266.361 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 4.56 | -12.33 | 2 | 4 | 0 | 59 | 265.353 | 8 | ↓ |