UCSF

ZINC25783591

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 35 Yes

CAS Numbers: 261351-43-3 , [261351-43-3]

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) 5.23 11.6 -14.44 4 7 0 94 472.589 6

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