UCSF

ZINC10327026

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2007 15 No

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) -0.70 0.99 -6.91 2 5 0 71 205.217 3
Lo Low (pH 4.5-6) -0.70 1.27 -35.8 3 5 1 72 206.225 3

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

No pre-computed analogs available. Try a structural similarity search.