In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2008 | 20 | No |
Popular Name: 3-[(4-ethoxyphenyl)imino]-1,3-dihydro-2H-indol-2-one 3-[(4-ethoxyphenyl)imino]-1,3-di…
2H-indol-2-one, 3-[(4-ethoxyphenyl)imino]-1,3-dihydro-
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) | 3.67 | 5.07 | -10.28 | 1 | 4 | 0 | 54 | 266.3 | 3 | ↓ |
Ref Reference (pH 7) | 3.67 | 5.38 | -9.73 | 1 | 4 | 0 | 54 | 266.3 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.13 | 3.61 | -47.78 | 0 | 4 | -1 | 58 | 265.292 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.13 | 3.09 | -49.9 | 0 | 4 | -1 | 58 | 265.292 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.