In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | Yes |
Popular Name: (2R)-2-[2-dimethylaminoethyl(isobutyl)amino]cyclohexanone (2R)-2-[2-dimethylaminoethyl(iso…
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) | 2.06 | 7.22 | -32.62 | 1 | 3 | 1 | 25 | 241.399 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 6.54 | -30.61 | 1 | 3 | 1 | 25 | 241.399 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 4.75 | -4.75 | 0 | 3 | 0 | 24 | 240.391 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.06 | 8.78 | -100.78 | 2 | 3 | 2 | 26 | 242.407 | 6 | ↓ |