| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 19 | No |
Popular Name: (1S,2S)-1-(4-bromo-2-thienyl)-N1-[(3R)-1,1-dioxothiolan-3-yl]-N1-methyl-propane-1,2-diamine (1S,2S)-1-(4-bromo-2-thienyl)-N1…
| 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) | 1.29 | 0.33 | -56.22 | 3 | 4 | 1 | 65 | 368.342 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 0.02 | -10.4 | 2 | 4 | 0 | 63 | 367.334 | 4 | ↓ |
