In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: (1S)-N'-[(1R)-1,3-dimethylbutyl]-1-(3-methoxyphenyl)-N,N-dimethyl-ethane-1,2-diamine (1S)-N'-[(1R)-1,3-dimethylbutyl]…
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) | 3.73 | 6.82 | -36.84 | 2 | 3 | 1 | 29 | 279.448 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.73 | 8.8 | -112.74 | 3 | 3 | 2 | 30 | 280.456 | 8 | ↓ |