In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 20 | No |
Popular Name: N1-ethyl-4-nitro-N1-(4-pyridylmethyl)benzene-1,2-diamine N1-ethyl-4-nitro-N1-(4-pyridylme…
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) | 1.90 | 7.51 | -7.29 | 2 | 6 | 0 | 88 | 272.308 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 7.97 | -42.46 | 3 | 6 | 1 | 89 | 273.316 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.