In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 21 | Yes |
Popular Name: 4-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-ylmethyl)-2-(2-thienyl)thiazole 4-(6,8-dihydro-5H-pyrido[3,4-d]p…
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) | 2.35 | 6.37 | -11.64 | 0 | 4 | 0 | 42 | 314.439 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.35 | 8.67 | -46.16 | 1 | 4 | 1 | 43 | 315.447 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.