In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 15 | Yes |
Popular Name: 6-(3-thienylmethylamino)-2H-1,2,4-triazine-3,5-dione 6-(3-thienylmethylamino)-2H-1,2,…
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) | -0.24 | -0.04 | -6.42 | 3 | 6 | 0 | 91 | 224.245 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.21 | -1.71 | -36.3 | 2 | 6 | -1 | 94 | 223.237 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.