In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: 3-[(6-amino-3-pyridyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one 3-[(6-amino-3-pyridyl)sulfanylme…
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) | 1.71 | 3.62 | -11.63 | 2 | 6 | 0 | 87 | 285.332 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 4.15 | -34.18 | 3 | 6 | 1 | 88 | 286.34 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.