In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (1R)-1-(4-chlorophenyl)-N-cyclopropyl-N-ethyl-ethane-1,2-diamine (1R)-1-(4-chlorophenyl)-N-cyclop…
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) | 2.15 | 6.87 | -122.83 | 4 | 2 | 2 | 32 | 240.778 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 4.58 | -48.46 | 3 | 2 | 1 | 31 | 239.77 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 6.66 | -29.22 | 3 | 2 | 1 | 30 | 239.77 | 5 | ↓ |