In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 14th, 2007 | 28 | Yes |
Popular Name: 3-[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]aminobenzoic 3-[2-[[4-allyl-5-(4-pyridyl)-1,2…
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) | 2.54 | -0.47 | -67.74 | 1 | 8 | -1 | 112 | 394.436 | 8 | ↓ |