In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 23 | Yes |
Popular Name: 3-cyclopropyl-2-[(5-hydroxypentylamino)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one 3-cyclopropyl-2-[(5-hydroxypenty…
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) | 1.85 | 6.62 | -60.58 | 3 | 5 | 1 | 72 | 336.481 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 5.18 | -15.28 | 2 | 5 | 0 | 67 | 335.473 | 8 | ↓ |