In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 25 | Yes |
Popular Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-[[2-hydroxyethyl(isopropyl)amino]methyl]benzamide N-(5-cyclopropyl-1,3,4-thiadiazo…
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) | 1.45 | 6.9 | -43.05 | 3 | 6 | 1 | 80 | 361.491 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.45 | 5.06 | -16.39 | 2 | 6 | 0 | 78 | 360.483 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.