| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 20 | No |
Popular Name: N-[(4-methyl-3-nitro-phenyl)methyl]-1,1-dioxo-thian-4-amine N-[(4-methyl-3-nitro-phenyl)meth…
| 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) | 1.62 | 5.02 | -75.1 | 2 | 6 | 1 | 97 | 299.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 3.81 | -18.94 | 1 | 6 | 0 | 92 | 298.364 | 4 | ↓ |
