In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 16th, 2011 | 16 | Yes |
Popular Name: (1R)-N-ethyl-1-(1-tetrahydropyran-4-ylpyrazol-4-yl)ethanamine (1R)-N-ethyl-1-(1-tetrahydropyra…
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) | 1.18 | 4.43 | -38.37 | 2 | 4 | 1 | 44 | 224.328 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.18 | 3.22 | -4.31 | 1 | 4 | 0 | 39 | 223.32 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.