UCSF

ZINC32605806

Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2009 28 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) 1.87 4.99 -44.53 3 7 0 108 417.874 6
Hi High (pH 8-9.5) 3.17 4.6 -55.9 2 7 -1 111 416.866 6

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