In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2010 | 20 | Yes |
Popular Name: (2R)-2-(1,3,4-thiadiazol-2-ylsulfanyl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propanamide (2R)-2-(1,3,4-thiadiazol-2-ylsul…
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) | 1.57 | 7.67 | -23.47 | 1 | 7 | 0 | 85 | 306.376 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.75 | 5.85 | -56.39 | 0 | 7 | -1 | 91 | 305.368 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.