| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 24 | No |
Popular Name: (NE)-N'-anilino-N-carbamimidoylimino-quinoline-8-carboxamidine (NE)-N'-anilino-N-carbamimidoyli…
| 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) | 3.05 | 8.86 | -28.2 | 5 | 7 | 1 | 113 | 318.364 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.05 | 9.36 | -77.41 | 6 | 7 | 2 | 115 | 319.372 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.05 | 7.88 | -79.53 | 6 | 7 | 2 | 115 | 319.372 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.05 | 8.47 | -79.25 | 6 | 7 | 2 | 115 | 319.372 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.05 | 8.5 | -76.63 | 6 | 7 | 2 | 115 | 319.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
