In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2011 | 17 | Yes |
Popular Name: N'-[(4-chloro-3-fluoro-phenyl)methyl]-N-cyclopropyl-N-methyl-ethane-1,2-diamine N'-[(4-chloro-3-fluoro-phenyl)me…
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) | 2.66 | 7.16 | -36.95 | 2 | 2 | 1 | 16 | 257.76 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 6.07 | -49.44 | 2 | 2 | 1 | 20 | 257.76 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 8.52 | -125.27 | 3 | 2 | 2 | 21 | 258.768 | 6 | ↓ |