| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (2R,3R)-2-amino-N,3-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2R,3R)-2-amino-N,3-dimethyl-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) | 0.46 | 3.67 | -56.84 | 4 | 6 | 1 | 94 | 309.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 0.68 | -77.3 | 3 | 6 | 0 | 97 | 308.407 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 0.4 | -59.95 | 2 | 6 | -1 | 95 | 307.399 | 5 | ↓ |
