UCSF

ZINC23931369

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 30 Yes

Popular Name: 4-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanylmethyl]-7-hydroxy-8-methyl-chromen-2-one 4-[(5-ethyl-[1,2,4]triazino[5,6-…

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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) 4.82 10.83 -18.12 1 7 0 94 418.478 4 ↓
Hi High (pH 8-9.5) 4.82 11.44 -47.74 0 7 -1 97 417.47 4 ↓

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

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