In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 15 | Yes |
Popular Name: (1S,2R)-2-[[2-(dimethylamino)-2-methyl-propyl]amino]cyclohexanol (1S,2R)-2-[[2-(dimethylamino)-2-…
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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) | 1.69 | 1.82 | -31.17 | 3 | 3 | 1 | 40 | 215.361 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 2.91 | -31.49 | 3 | 3 | 1 | 37 | 215.361 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.69 | 3.95 | -105.67 | 4 | 3 | 2 | 41 | 216.369 | 4 | ↓ |