In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | No |
Popular Name: 2-[4-(methylaminomethyl)-2-nitro-phenoxy]-N-propyl-acetamide 2-[4-(methylaminomethyl)-2-nitro…
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) | 1.43 | 6.05 | -68.74 | 3 | 7 | 1 | 101 | 282.32 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 4.61 | -22.33 | 2 | 7 | 0 | 96 | 281.312 | 8 | ↓ |