In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2011 | 15 | Yes |
Popular Name: 1-[1-(3,3-dimethylbutyl)-5-methyl-pyrazol-4-yl]-N-methyl-methanamine 1-[1-(3,3-dimethylbutyl)-5-methy…
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) | 2.07 | 5.93 | -40.65 | 2 | 3 | 1 | 34 | 210.345 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 4.49 | -5.31 | 1 | 3 | 0 | 30 | 209.337 | 5 | ↓ |