In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (1R)-1-(4-fluorophenyl)-N-methyl-N-[(1R)-1-methylpropyl]ethane-1,2-diamine (1R)-1-(4-fluorophenyl)-N-methyl…
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) | 2.10 | 6.33 | -125.48 | 4 | 2 | 2 | 32 | 226.339 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 4.48 | -47.39 | 3 | 2 | 1 | 31 | 225.331 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 6.5 | -31.69 | 3 | 2 | 1 | 30 | 225.331 | 5 | ↓ |