In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | Yes |
Popular Name: 5,6-dimethyl-2-[(2-pyridylmethylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-2-[(2-pyridylmethyl…
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) | 1.24 | 4.22 | -13.4 | 2 | 5 | 0 | 71 | 300.387 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.24 | 5.62 | -56.7 | 3 | 5 | 1 | 75 | 301.395 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 3.49 | -59.13 | 3 | 5 | 1 | 72 | 301.395 | 4 | ↓ |