In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2009 | 30 | Yes |
Popular Name: N-(2-cyclopentylsulfanylphenyl)-2,4-dioxo-1-propyl-pyrido[5,6-e]pyrimidine-6-carboxamide N-(2-cyclopentylsulfanylphenyl)-…
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) | 3.33 | 9.49 | -12.47 | 2 | 7 | 0 | 97 | 424.526 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 7.71 | -49.45 | 1 | 7 | -1 | 100 | 423.518 | 6 | ↓ |