| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 35 | No |
Popular Name: (E)-N-(benzo[d]thiazol-2-yl)-2-cyano-3-(1-(4-nitrobenzyl)-1H-indol-3-yl)acrylamide (E)-N-(benzo[d]thiazol-2-yl)-2-c…
None
| 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) | 5.53 | 13.54 | -56.29 | 0 | 8 | -1 | 123 | 478.513 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.34 | 15.21 | -19.49 | 1 | 8 | 0 | 117 | 479.521 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.