In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 26 | No |
Popular Name: 5-(2,4-dichloroanilino)-2-(2,6-dichloro-4-nitro-phenyl)-1H-pyrazol-3-one 5-(2,4-dichloroanilino)-2-(2,6-d…
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) | 5.33 | 11.67 | -8.83 | 1 | 7 | 0 | 91 | 434.066 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.33 | 11.19 | -24.96 | 0 | 7 | -1 | 93 | 433.058 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.