UCSF

ZINC39885478

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 26 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) 4.43 9.47 -17.41 1 5 0 64 389.477 7
Hi High (pH 8-9.5) 4.50 7.81 -50.91 0 5 -1 70 388.469 7

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