In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1R)-1-(3-bromo-4-fluoro-phenyl)-N-cyclopropyl-N-propyl-ethane-1,2-diamine (1R)-1-(3-bromo-4-fluoro-phenyl)…
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) | 2.87 | 7.71 | -130.68 | 4 | 2 | 2 | 32 | 317.246 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 5.52 | -50.37 | 3 | 2 | 1 | 31 | 316.238 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 7.7 | -34.76 | 3 | 2 | 1 | 30 | 316.238 | 6 | ↓ |