UCSF

ZINC69462996

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 23 Yes

Popular Name: 6-[(2S)-2-methyl-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-1-yl]-[1,2,4]triazolo[3,4-f]pyridazine 6-[(2S)-2-methyl-4-[2-(1,2,4-tri…

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Physical Representations

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) -0.15 9.11 -19.15 0 9 0 80 313.369 4 ↓
Mid Mid (pH 6-8) -0.15 11.33 -67.42 1 9 1 81 314.377 4 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.