In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 26 | No |
Popular Name: 4-methyl-N'-(2-oxoindol-3-yl)-5-phenyl-2H-pyrazole-3-carbohydrazide 4-methyl-N'-(2-oxoindol-3-yl)-5-…
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) | 3.00 | 5.11 | -17.24 | 3 | 7 | 0 | 103 | 345.362 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 3.13 | -57.57 | 2 | 7 | -1 | 106 | 344.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 3.24 | -54.84 | 2 | 7 | -1 | 106 | 344.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 2.61 | -54.21 | 2 | 7 | -1 | 109 | 344.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 2.68 | -47.48 | 2 | 7 | -1 | 109 | 344.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 3.57 | -58.56 | 2 | 7 | -1 | 109 | 344.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.91 | 3.62 | -48.88 | 2 | 7 | -1 | 109 | 344.354 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 1.82 | -13.04 | 3 | 7 | 0 | 107 | 345.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 5.02 | -17.14 | 3 | 7 | 0 | 103 | 345.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 2.76 | -19.66 | 3 | 7 | 0 | 107 | 345.362 | 3 | ↓ |