In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 18 | No |
Popular Name: 1-(2-dimethylaminoethyl)-5-phenyl-pyrazole-4-carbaldehyde 1-(2-dimethylaminoethyl)-5-pheny…
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) | 1.81 | 7.38 | -44.16 | 1 | 4 | 1 | 39 | 244.318 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.81 | 4.9 | -7.72 | 0 | 4 | 0 | 38 | 243.31 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.