UCSF

ZINC10528882

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 31 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.83 -1 -16.04 0 4 0 46 486.087 8
Lo Low (pH 4.5-6) 4.83 -0.88 -46.42 1 4 1 47 487.095 8

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