In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1S)-1-(4-ethylphenyl)-N,N'-dimethyl-N'-[(1S)-1,2,2-trimethylpropyl]ethane-1,2-diamine (1S)-1-(4-ethylphenyl)-N,N'-dime…
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) | 4.66 | 10.64 | -114.95 | 3 | 2 | 2 | 21 | 278.484 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.66 | 9.54 | -34.52 | 2 | 2 | 1 | 20 | 277.476 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.66 | 9.61 | -32.51 | 2 | 2 | 1 | 16 | 277.476 | 7 | ↓ |