UCSF

ZINC65743122

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2011 27 No

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) -3.77 0.01 -361.64 2 15 -4 241 465.166 8
Mid Mid (pH 6-8) -3.77 -1.15 -227.97 3 15 -3 238 466.174 8

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

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