In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: N-[(4-chloro-3-fluoro-phenyl)methyl]-3-isopropoxy-propan-1-amine N-[(4-chloro-3-fluoro-phenyl)met…
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) | 3.26 | 7.36 | -50.08 | 2 | 2 | 1 | 26 | 260.76 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.26 | 6.01 | -4.97 | 1 | 2 | 0 | 21 | 259.752 | 7 | ↓ |