UCSF

ZINC03650230

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 10 No

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) -1.16 -3.3 -8.96 3 4 0 78 148.158 4

Vendor Notes

Note Type Comments Provided By
Patent Database Links US2005267169 ChEBI

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