In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 24 | Yes |
Popular Name: N-(3-phenyl-1,2,4-thiadiazol-5-yl)quinoxaline-2-carboxamide N-(3-phenyl-1,2,4-thiadiazol-5-y…
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) | 3.50 | 6.2 | -9.88 | 1 | 6 | 0 | 81 | 333.376 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.57 | 4.45 | -48.29 | 0 | 6 | -1 | 87 | 332.368 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.