In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 14 | Yes |
Popular Name: N-[(3-chloro-4-fluoro-phenyl)methyl]but-2-yn-1-amine N-[(3-chloro-4-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) | 3.24 | 5.89 | -5.74 | 1 | 1 | 0 | 12 | 211.667 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 7.27 | -49 | 2 | 1 | 1 | 17 | 212.675 | 3 | ↓ |