| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 28 | Yes |
Popular Name: 3-[[(4R)-2-chloro-4H-purin-6-yl]amino]-N-(3,4,5-trimethoxyphenyl)propanamide 3-[[(4R)-2-chloro-4H-purin-6-yl]…
| 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) | 0.73 | 0.41 | -40.38 | 1 | 10 | -1 | 120 | 405.822 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 0.91 | -16.35 | 2 | 10 | 0 | 118 | 406.83 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
