In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 21 | No |
Popular Name: 1-[(1R)-1-isocyanato-2-(3-methoxyphenyl)ethyl]-4-methoxy-benzene 1-[(1R)-1-isocyanato-2-(3-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) | 3.54 | 5.84 | -7.87 | 0 | 4 | 0 | 48 | 283.327 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.54 | 6.92 | -43.97 | 1 | 4 | 1 | 50 | 284.335 | 6 | ↓ |