In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 25 | No |
Popular Name: N-[(5-bromo-1-butyl-2-oxo-indolin-3-ylidene)amino]pyridine-4-carboxamide N-[(5-bromo-1-butyl-2-oxo-indoli…
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) | 3.34 | 7.81 | -16.63 | 1 | 6 | 0 | 76 | 401.264 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 6.54 | -49 | 0 | 6 | -1 | 83 | 400.256 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 5.6 | -46.73 | 0 | 6 | -1 | 83 | 400.256 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 4.79 | -10.82 | 1 | 6 | 0 | 80 | 401.264 | 5 | ↓ |