In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 16 | Yes |
Popular Name: [2-isopropyl-4-(2-thienyl)pyrimidin-5-yl]methanamine [2-isopropyl-4-(2-thienyl)pyrimi…
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) | 1.78 | 4.21 | -44.95 | 3 | 3 | 1 | 53 | 234.348 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 4.22 | -6.85 | 2 | 3 | 0 | 52 | 233.34 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.