In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 21 | No |
Popular Name: 3-nitro-N-(3-pyridylmethyl)-5-(trifluoromethyl)pyridin-2-amine 3-nitro-N-(3-pyridylmethyl)-5-(t…
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) | 1.85 | 6.58 | -7.65 | 1 | 6 | 0 | 84 | 298.224 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.85 | 7.05 | -39.13 | 2 | 6 | 1 | 85 | 299.232 | 5 | ↓ |