UCSF

ZINC35017707

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 31 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) -1.08 1.42 -19.27 2 10 0 128 431.424 4
Mid Mid (pH 6-8) -1.08 2.41 -51.14 1 10 -1 131 430.416 4
Lo Low (pH 4.5-6) -1.08 3.18 -41.48 3 10 1 130 432.432 4

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