In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 25 | Yes |
Popular Name: 2-isopropyl-4-[[4-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperazin-1-yl]methyl]oxazole 2-isopropyl-4-[[4-(7-methylthien…
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) | 3.00 | 5.71 | -10.57 | 0 | 6 | 0 | 58 | 357.483 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 7.92 | -45.23 | 1 | 6 | 1 | 59 | 358.491 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.