In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 27 | Yes |
Popular Name: 3-[(4R)-4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl]-N-[3-(3-pyridyl)propyl]benzamide 3-[(4R)-4-methyl-1,1,3-trioxo-1,…
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) | 1.60 | 4.72 | -26.22 | 1 | 7 | 0 | 96 | 387.461 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.60 | 5.19 | -56.14 | 2 | 7 | 1 | 98 | 388.469 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.