In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 1-tert-butyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-4-amine 1-tert-butyl-N-[(1,3,5-trimethyl…
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) | 1.92 | 6.42 | -35.48 | 2 | 4 | 1 | 34 | 279.452 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 7.61 | -108.67 | 3 | 4 | 2 | 39 | 280.46 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 5.49 | -42.23 | 2 | 4 | 1 | 38 | 279.452 | 4 | ↓ |