In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | No |
Popular Name: (4R)-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]thiazolidine-4-carboxamide (4R)-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) | 0.12 | 3.49 | -54.57 | 3 | 6 | 1 | 83 | 311.412 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.58 | -0.38 | -53.71 | 1 | 6 | -1 | 81 | 309.396 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.12 | 2.39 | -19.44 | 2 | 6 | 0 | 78 | 310.404 | 3 | ↓ |