In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 8th, 2011 | 26 | No |
Popular Name: N'-[(6S)-6-benzyl-5-oxo-6H-1,2,4-triazin-3-yl]-4-methyl-benzenesulfonohydrazide N'-[(6S)-6-benzyl-5-oxo-6H-1,2,4…
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) | 1.97 | 4.47 | -50.72 | 3 | 8 | 1 | 114 | 372.43 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.97 | 4.75 | -36.52 | 2 | 8 | 0 | 116 | 371.422 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.