In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2006 | 24 | No |
Popular Name: benzoic acid, 4-(1,1-dimethylethyl)-, (1,2-dihydro-2-oxo-3H-indol-3-ylidene)hydrazide benzoic acid, 4-(1,1-dimethyleth…
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) | 4.04 | 6.93 | -12.05 | 2 | 5 | 0 | 74 | 321.38 | 3 | ↓ |
Ref Reference (pH 7) | 4.04 | 6.78 | -18.05 | 2 | 5 | 0 | 74 | 321.38 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.50 | 4.87 | -57.84 | 1 | 5 | -1 | 77 | 320.372 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.50 | 5.19 | -47.21 | 1 | 5 | -1 | 77 | 320.372 | 3 | ↓ |