In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: (1R)-1-(2-ethoxyphenyl)-N-methyl-N-[(1S)-1,2,2-trimethylpropyl]ethane-1,2-diamine (1R)-1-(2-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) | 3.15 | 7.32 | -114.82 | 4 | 3 | 2 | 41 | 280.456 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 7.08 | -27.74 | 3 | 3 | 1 | 40 | 279.448 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.15 | 6.12 | -41.08 | 3 | 3 | 1 | 40 | 279.448 | 7 | ↓ |