UCSF

ZINC26067203

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2009 31 Yes

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) 3.15 2.95 -15.1 3 8 0 100 473.401 10
Mid Mid (pH 6-8) 3.15 4.91 -51.6 4 8 1 101 474.409 10

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