In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: (1S)-1-(4-ethoxyphenyl)-N-[(1R)-1-(4-iodophenyl)ethyl]ethanamine (1S)-1-(4-ethoxyphenyl)-N-[(1R)-…
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) | 5.53 | 10.78 | -43.31 | 2 | 2 | 1 | 26 | 396.292 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.53 | 9.82 | -3.34 | 1 | 2 | 0 | 21 | 395.284 | 6 | ↓ |