In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 16 | Yes |
Popular Name: 1-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-2-furyl]-N-methyl-methanamine 1-[3-[(3,5-dimethylpyrazol-1-yl)…
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) | 1.17 | 5.26 | -38.26 | 2 | 4 | 1 | 48 | 220.296 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.17 | 5.36 | -92.21 | 3 | 4 | 2 | 49 | 221.304 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.