In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2011 | 24 | Yes |
Popular Name: 2-(2-aminoethyl)-5,6-dimethyl-N-[3-(4-pyridyl)propyl]thieno[2,3-d]pyrimidin-4-amine 2-(2-aminoethyl)-5,6-dimethyl-N-…
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) | 2.00 | 6.99 | -51.49 | 4 | 5 | 1 | 78 | 342.492 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 6.59 | -11.12 | 3 | 5 | 0 | 77 | 341.484 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 7.44 | -91.96 | 5 | 5 | 2 | 80 | 343.5 | 7 | ↓ |