UCSF

ZINC35653215

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 16 No

CAS Number: 1009816-48-1

Other Names:

Thiamet G

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) -1.14 -5.89 -28.24 5 6 1 96 249.312 3
Hi High (pH 8-9.5) -1.14 -6.89 -12.94 4 6 0 94 248.304 3

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

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