UCSF

ZINC39846545

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 39 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 6.00 16.73 -14.84 1 5 0 52 514.673 8
Lo Low (pH 4.5-6) 6.00 18.3 -49.11 2 5 1 53 515.681 8

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