UCSF

ZINC38138332

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2009 41 No

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) 0.59 3.86 -106.46 5 14 -2 231 611.561 9
Hi High (pH 8-9.5) 0.59 4.77 -174.28 4 14 -3 233 610.553 9
Mid Mid (pH 6-8) 0.59 4.77 -168.11 4 14 -3 233 610.553 9

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

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