In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | No |
Popular Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-(2,2,2-trifluoroethyl)propan-1-amine N-[(2-chloro-5-nitro-phenyl)meth…
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) | 4.11 | 7.75 | -6.5 | 0 | 4 | 0 | 49 | 310.703 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.11 | 9.74 | -42.72 | 1 | 4 | 1 | 50 | 311.711 | 7 | ↓ |