In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2011 | 20 | No |
Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-pyridin-4-amine N-(1,3-benzodioxol-5-ylmethyl)-3…
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 | 4.93 | -11.46 | 1 | 7 | 0 | 89 | 273.248 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 5.4 | -48.5 | 2 | 7 | 1 | 90 | 274.256 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.