In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 24 | No |
Popular Name: 4-[(Z)-(3-butoxy-4-methoxy-phenyl)methyleneamino]-6-methyl-3-thioxo-2H-1,2,4-triazin-5-one 4-[(Z)-(3-butoxy-4-methoxy-pheny…
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) | 2.40 | 6.15 | -43.45 | 0 | 7 | -1 | 85 | 347.42 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 6.84 | -14.16 | 1 | 7 | 0 | 82 | 348.428 | 7 | ↓ |