| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 21 | Yes |
Popular Name: 2-[(4-ethylpiperazine-1-carbonyl)amino]-5-iodo-benzoic 2-[(4-ethylpiperazine-1-carbonyl…
| 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) | 3.06 | 8.84 | -59.75 | 2 | 6 | 0 | 77 | 403.22 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 6.6 | -42.49 | 1 | 6 | -1 | 76 | 402.212 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
