In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: N-(4,5,6,7,8,9-hexahydrocycloocta[d]thiazol-2-yl)thiadiazole-5-carboxamide N-(4,5,6,7,8,9-hexahydrocyclooct…
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) | 2.96 | 5.1 | -11.16 | 1 | 5 | 0 | 68 | 294.405 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 3.49 | -40.17 | 0 | 5 | -1 | 74 | 293.397 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.