In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 21 | No |
Popular Name: (1S)-1-(2-chlorophenyl)-N-[(5-fluoro-2-nitro-phenyl)methyl]ethanamine (1S)-1-(2-chlorophenyl)-N-[(5-fl…
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) | 4.14 | 9.92 | -39.52 | 2 | 4 | 1 | 62 | 309.748 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.14 | 8.94 | -5.87 | 1 | 4 | 0 | 58 | 308.74 | 5 | ↓ |