In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 18 | Yes |
Popular Name: 4-chloro-2-[[[(2R)-2-dimethylamino-3-methyl-butyl]amino]methyl]phenol 4-chloro-2-[[[(2R)-2-dimethylami…
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) | 3.23 | 4.01 | -37.9 | 3 | 3 | 1 | 40 | 271.812 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 4.79 | -28.98 | 2 | 3 | 0 | 43 | 270.804 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 4.85 | -33.94 | 3 | 3 | 1 | 37 | 271.812 | 6 | ↓ |