In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 20 | Yes |
Popular Name: 2-chloro-4-[4-(2-dimethylaminoethyloxy)phenyl]phenol 2-chloro-4-[4-(2-dimethylaminoet…
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) | 4.21 | 7.51 | -38.19 | 2 | 3 | 1 | 34 | 292.786 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 4.91 | -6.26 | 1 | 3 | 0 | 33 | 291.778 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 5.57 | -42.42 | 0 | 3 | -1 | 36 | 290.77 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 8.17 | -67.56 | 1 | 3 | 0 | 37 | 291.778 | 5 | ↓ |