In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 19 | Yes |
Popular Name: (1R)-1-(4-dimethylaminophenyl)-N-[(1R)-1,2-dimethylpropyl]-N-methyl-ethane-1,2-diamine (1R)-1-(4-dimethylaminophenyl)-N…
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) | 2.28 | 7.22 | -123.6 | 4 | 3 | 2 | 35 | 265.445 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.28 | 5.6 | -45.03 | 3 | 3 | 1 | 34 | 264.437 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.28 | 7.34 | -27.65 | 3 | 3 | 1 | 34 | 264.437 | 6 | ↓ |