UCSF

ZINC34945002

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 32 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) 3.74 11.81 -11.52 0 5 0 44 456.03 9
Mid Mid (pH 6-8) 3.74 14.02 -55.14 1 5 1 45 457.038 9

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