| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 16th, 2008 | 30 | No |
Popular Name: N-[(5-bromo-2-oxo-indolin-3-ylidene)amino]-5-(1-naphthyl)-1H-pyrazole-3-carboxamide N-[(5-bromo-2-oxo-indolin-3-ylid…
| 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 | 5.15 | -20.75 | 3 | 7 | 0 | 107 | 460.291 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.48 | 5.97 | -47.92 | 2 | 7 | -1 | 109 | 459.283 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.48 | 5.01 | -51.32 | 2 | 7 | -1 | 109 | 459.283 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.48 | 5 | -46.39 | 2 | 7 | -1 | 109 | 459.283 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.48 | 5.97 | -56.33 | 2 | 7 | -1 | 109 | 459.283 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 5.79 | -46.7 | 2 | 7 | -1 | 106 | 459.283 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 5.83 | -41.07 | 2 | 7 | -1 | 106 | 459.283 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.48 | 5.15 | -20.81 | 3 | 7 | 0 | 107 | 460.291 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.57 | 7.53 | -14.09 | 3 | 7 | 0 | 103 | 460.291 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | 7.59 | -36.86 | 4 | 7 | 1 | 101 | 461.299 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.48 | 4.19 | -11.32 | 3 | 7 | 0 | 107 | 460.291 | 3 | ↓ |
