In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 9th, 2009 | 32 | Yes |
Popular Name: 2-[[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]methyl]-3H-thieno[2,3-e]pyrimidin-4-one 2-[[4-(4-cyclohexylphenyl)sulfon…
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) | 3.81 | 7.1 | -28.22 | 1 | 7 | 0 | 86 | 472.636 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 8.93 | -83.51 | 2 | 7 | 1 | 88 | 473.644 | 5 | ↓ |