| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2011 | 23 | Yes |
Popular Name: 2-(3-hydroxypropylsulfanyl)-3-(4-methyl-2-pyridyl)quinazolin-4-one 2-(3-hydroxypropylsulfanyl)-3-(4…
| 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) | 2.81 | 6.51 | -15.83 | 1 | 5 | 0 | 68 | 327.409 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.93 | 7.52 | -32.02 | 2 | 5 | 1 | 72 | 328.417 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
