| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2007 | 28 | No |
Popular Name: acetic acid, (4-nitrophenoxy)-, 2-[[(3,5-dichlorobenzoyl)amino]thioxomethyl]hydrazide acetic acid, (4-nitrophenoxy)-, …
| 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) | 3.33 | 9.42 | -31.66 | 3 | 9 | 0 | 125 | 443.268 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 9.25 | -60.85 | 2 | 9 | -1 | 126 | 442.26 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.