In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 12 | Yes |
Popular Name: (2R)-3-[2-dimethylaminoethyl(methyl)amino]-2-methyl-propanenitrile (2R)-3-[2-dimethylaminoethyl(met…
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) | 0.90 | 4.46 | -39.49 | 1 | 3 | 1 | 31 | 170.28 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.90 | 1.99 | -4.75 | 0 | 3 | 0 | 30 | 169.272 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.90 | 6.53 | -118.5 | 2 | 3 | 2 | 33 | 171.288 | 5 | ↓ |