In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 9th, 2008 | 23 | Yes |
Popular Name: 3-cyclohexyl-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]propanamide 3-cyclohexyl-N-methyl-N-[(4-oxo-…
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) | 2.99 | 8.29 | -17.13 | 1 | 5 | 0 | 66 | 333.457 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.44 | 7.18 | -52.86 | 0 | 5 | -1 | 69 | 332.449 | 5 | ↓ |