| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 21 | Yes |
Popular Name: (2R)-2-(9H-purin-6-ylsulfanyl)-N-(2-thienylmethyl)propanamide (2R)-2-(9H-purin-6-ylsulfanyl)-N…
| 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) | 1.31 | 6.63 | -15.06 | 2 | 6 | 0 | 84 | 319.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 6.15 | -42.16 | 1 | 6 | -1 | 82 | 318.407 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
