UCSF

ZINC40772985

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 29 No

Other Names:

Co-lupulone

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) 5.21 14.11 -42.03 0 4 -1 74 399.551 8
Mid Mid (pH 6-8) 4.63 12.66 -5.92 0 4 0 68 400.559 8

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

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