In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 19 | Yes |
Popular Name: (1R)-1-(4-ethoxyphenyl)-N-methyl-N-[(1S)-1-methylbutyl]ethane-1,2-diamine (1R)-1-(4-ethoxyphenyl)-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) | 2.93 | 6.99 | -125.41 | 4 | 3 | 2 | 41 | 266.429 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.93 | 6.73 | -32.39 | 3 | 3 | 1 | 40 | 265.421 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.93 | 4.72 | -45.81 | 3 | 3 | 1 | 40 | 265.421 | 8 | ↓ |