| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 26 | Yes |
Popular Name: N-(4-butoxyphenyl)-2-(9H-purin-6-ylsulfanyl)propanamide N-(4-butoxyphenyl)-2-(9H-purin-6…
| 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) | 3.20 | 9.21 | -16.99 | 2 | 7 | 0 | 93 | 371.466 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 8.72 | -44.18 | 1 | 7 | -1 | 91 | 370.458 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
