UCSF

ZINC20358128

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 10 Yes

Other Names:

MFCD08751339

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) -0.01 1.84 -28.39 2 3 1 39 139.178 1
Mid Mid (pH 6-8) -0.01 1.42 -13 1 3 0 38 138.17 1

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

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