UCSF

ZINC95535317

Substance Information

In ZINC since Heavy atoms Benign functionality
December 18th, 2013 36 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 8.31 17.04 -3.92 0 2 0 6 515.528 8
Mid Mid (pH 6-8) 8.31 18.93 -46.02 1 2 1 8 516.536 8

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

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