UCSF

ZINC21512594

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 4.13 9.07 -1.8 2 1 0 26 349.088 3
Mid Mid (pH 6-8) 4.13 9.25 -35.69 3 1 1 28 350.096 3

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