| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 16th, 2009 | 28 | No |
Popular Name: (2S)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[4-(3-nitrophenyl)thiazol-2-yl]propanamide (2S)-2-(4,6-diaminopyrimidin-2-y…
| 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) | 2.75 | 6.36 | -22.59 | 5 | 10 | 0 | 166 | 417.476 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 5.29 | -52.81 | 4 | 10 | -1 | 172 | 416.468 | 6 | ↓ |
