In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | No |
Popular Name: 4-[(1S)-1-isocyanato-2-(4-methoxyphenyl)ethyl]-1,2-dimethoxy-benzene 4-[(1S)-1-isocyanato-2-(4-methox…
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) | 3.16 | 5.75 | -9.96 | 0 | 5 | 0 | 57 | 313.353 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.16 | 6.83 | -50.96 | 1 | 5 | 1 | 59 | 314.361 | 7 | ↓ |