UCSF

ZINC33650806

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2009 28 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) -3.20 1.45 -368.69 1 15 -4 235 462.137 8
Mid Mid (pH 6-8) -3.20 0.29 -231.11 2 15 -3 232 463.145 8

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

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