In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(3,5-dimethylphenyl)-N-isobutyl-N-(2-methoxyethyl)ethane-1,2-diamine (1S)-1-(3,5-dimethylphenyl)-N-is…
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 | 7.2 | -119.07 | 4 | 3 | 2 | 41 | 280.456 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 6.31 | -45.44 | 3 | 3 | 1 | 40 | 279.448 | 8 | ↓ |