In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: 2-[4-[[(1S,2R)-1,2-dimethylbutyl]amino]pyrazol-1-yl]-N-methyl-acetamide 2-[4-[[(1S,2R)-1,2-dimethylbutyl…
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) | 1.90 | 3.09 | -14.27 | 2 | 5 | 0 | 59 | 238.335 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 3.21 | -45.92 | 3 | 5 | 1 | 64 | 239.343 | 6 | ↓ |