In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2009 | 16 | Yes |
Popular Name: N-[(1S)-1-(4-isopropoxyphenyl)ethyl]ethane-1,2-diamine N-[(1S)-1-(4-isopropoxyphenyl)et…
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) | 1.66 | 4.09 | -124.41 | 5 | 3 | 2 | 53 | 224.348 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 2.98 | -44.18 | 4 | 3 | 1 | 49 | 223.34 | 6 | ↓ |