| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2010 | 23 | Yes |
Popular Name: (3E)-5-chloro-3-[5-(dimethylamino)-3H-isobenzofuran-1-ylidene]indolin-2-one (3E)-5-chloro-3-[5-(dimethylamin…
| 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) | 3.69 | 7.27 | -11.03 | 1 | 4 | 0 | 45 | 326.783 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.69 | 7.75 | -45.95 | 2 | 4 | 0 | 47 | 327.791 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.69 | 8.07 | -39.16 | 2 | 4 | 0 | 47 | 327.791 | 1 | ↓ |
