UCSF

ZINC02086917

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 33 Yes

Popular Name: 3-(butylsulfanyl)-6-(3-phenoxyphenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine 3-(butylsulfanyl)-6-(3-phenoxyph…

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Other Names:

MFCD02071126

Download: MOL2 SDF SMILES Flexibase

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) 6.88 -2.7 -11.98 1 6 0 69 456.571 7 ↓

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

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