| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 21 | No |
Popular Name: N'-[(2-chloro-5-nitro-phenyl)methyl]-N-isopropyl-N-methyl-butane-1,4-diamine N'-[(2-chloro-5-nitro-phenyl)met…
| 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 | 10.48 | -103.18 | 3 | 5 | 2 | 67 | 315.845 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 9.11 | -36.03 | 2 | 5 | 1 | 62 | 314.837 | 9 | ↓ |
