In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 3rd, 2008 | 21 | Yes |
Popular Name: (1S)-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]cyclohex-3-ene-1-carboxamide (1S)-N-methyl-N-[(4-oxo-3H-thien…
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) | 1.77 | 6.6 | -16.9 | 1 | 5 | 0 | 66 | 303.387 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 3.81 | -61.25 | 0 | 5 | -1 | 69 | 302.379 | 3 | ↓ |