In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 31 | Yes |
Popular Name: 2-[4-[4-[2-[[(2S)-2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]ethyl]phenoxy]phenoxy]acetic 2-[4-[4-[2-[[(2S)-2-(3-chlorophe…
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) | 4.08 | 10.96 | -83.84 | 3 | 6 | 0 | 95 | 441.911 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.08 | 9.62 | -47.22 | 2 | 6 | -1 | 91 | 440.903 | 11 | ↓ |