In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 19 | Yes |
Popular Name: 2-[(1-aminocyclopentanecarbonyl)amino]-5-iodo-benzoic 2-[(1-aminocyclopentanecarbonyl)…
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) | 3.10 | 5.44 | -55.47 | 4 | 5 | 0 | 97 | 374.178 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.10 | 5.23 | -40.18 | 3 | 5 | -1 | 95 | 373.17 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.