| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 14 | Yes |
Popular Name: (1-(2-chlorophenyl)-1H-pyrazol-4-yl)methanamine (1-(2-chlorophenyl)-1H-pyrazol-4…
Find On: PubMed — Wikipedia — Google
CAS Number: 400877-18-1
| 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) | 1.62 | 4.45 | -50.54 | 3 | 3 | 1 | 45 | 208.672 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 4.05 | -7.93 | 2 | 3 | 0 | 44 | 207.664 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
