| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 15 | No |
Popular Name: (3S)-3-(2-hydroxyphenyl)-5-methyl-3,4-dihydropyrazole-2-carbaldehyde (3S)-3-(2-hydroxyphenyl)-5-methy…
| 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) | 1.67 | 2.76 | -13.55 | 1 | 4 | 0 | 53 | 204.229 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 3.51 | -40.89 | 0 | 4 | -1 | 56 | 203.221 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
