| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2010 | 25 | Yes |
Popular Name: (3S)-N-[[4-(diethylaminomethyl)thiazol-2-yl]methyl]-3-(4-fluorophenyl)butanamide (3S)-N-[[4-(diethylaminomethyl)t…
| 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) | 3.31 | 9.32 | -39.36 | 2 | 4 | 1 | 46 | 364.51 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 6.85 | -8.86 | 1 | 4 | 0 | 45 | 363.502 | 9 | ↓ |
