In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 15 | Yes |
Popular Name: 3-[(3-chloro-4-fluoro-phenyl)methylamino]propanamide 3-[(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) | 1.27 | 2.61 | -53.97 | 4 | 3 | 1 | 60 | 231.678 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.27 | 1.26 | -9.44 | 3 | 3 | 0 | 55 | 230.67 | 5 | ↓ |