In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: 4-[(1S)-1-[(5-chloro-2-methoxy-phenyl)amino]ethyl]benzene-1,3-diol 4-[(1S)-1-[(5-chloro-2-methoxy-p…
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) | 3.85 | 2.13 | -11.55 | 3 | 4 | 0 | 62 | 293.75 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.85 | 2.9 | -46.41 | 2 | 4 | -1 | 65 | 292.742 | 4 | ↓ |