| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 33 | No |
Popular Name: 3-(4-benzoxyphenyl)-N-[(Z)-(2-ketoindolin-3-ylidene)amino]-1H-pyrazole-5-carboxamide 3-(4-benzoxyphenyl)-N-[(Z)-(2-ke…
| 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) | 4.28 | 7.84 | -19.59 | 3 | 8 | 0 | 112 | 437.459 | 6 | ↓ |
| Ref Reference (pH 7) | 4.28 | 7.97 | -13.97 | 3 | 8 | 0 | 112 | 437.459 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.74 | 6.21 | -45.11 | 2 | 8 | -1 | 115 | 436.451 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.74 | 5.95 | -56.49 | 2 | 8 | -1 | 115 | 436.451 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.74 | 5.89 | -60.17 | 2 | 8 | -1 | 115 | 436.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.10 | 7.96 | -38.09 | 4 | 8 | 1 | 110 | 438.467 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.28 | 7.77 | -20.31 | 3 | 8 | 0 | 112 | 437.459 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-(4-benzoxyphenyl)-N-[(2-ketoindolin-3-ylidene)amino]-1H-pyrazole-5-carboxamide](http://zinc12.docking.org/img/rings/229531.gif)