| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2009 | 24 | Yes |
Popular Name: 4-({[2-(cyclohexylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzoic acid 4-({[2-(cyclohexylamino)-3,4-dio…
| 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) | 3.98 | 2.21 | -57.5 | 2 | 6 | -1 | 105 | 327.36 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 4.01 | -147.55 | 4 | 6 | 1 | 105 | 329.376 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.