In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2011 | 22 | Yes |
Popular Name: 4-[2-(4-chloro-6-isopropyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethyl]morpholine 4-[2-(4-chloro-6-isopropyl-thien…
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) | 4.73 | 6.29 | -6.41 | 0 | 4 | 0 | 38 | 357.932 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.73 | 8.57 | -40.35 | 1 | 4 | 1 | 39 | 358.94 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.