In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 22 | No |
Popular Name: (5Z)-1-allyl-5-(2H-benzimidazol-2-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione (5Z)-1-allyl-5-(2H-benzimidazol-…
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) | 1.66 | 2.71 | -99.69 | 2 | 6 | 1 | 86 | 313.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 4.64 | -109.88 | 3 | 6 | 2 | 83 | 314.37 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.