In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 29 | No |
Popular Name: (3E)-1-[(diallylamino)methyl]-3-[3-(trifluoromethyl)phenyl]imino-indolin-2-one (3E)-1-[(diallylamino)methyl]-3-…
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) | 5.48 | 10.08 | -10.03 | 0 | 4 | 0 | 38 | 399.416 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.48 | 12.63 | -41.29 | 1 | 4 | 1 | 39 | 400.424 | 8 | ↓ |