UCSF

ZINC37816925

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 21 Yes

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) -0.28 6.08 -9.8 2 5 0 73 292.379 8
Mid Mid (pH 6-8) -0.28 6.51 -45.54 3 5 1 74 293.387 8

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Rings

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