In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2010 | 18 | Yes |
Popular Name: 2-[[isopentyl(methyl)amino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[isopentyl(methyl)amino]methy…
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) | 2.76 | 4.48 | -46.29 | 1 | 4 | 0 | 53 | 265.382 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 7.18 | -50.68 | 2 | 4 | 1 | 50 | 266.39 | 5 | ↓ |