UCSF

ZINC34870574

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 37 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) 5.82 14.16 -37.33 3 6 1 75 511.671 5
Mid Mid (pH 6-8) 5.82 13.73 -21.08 2 6 0 74 510.663 5

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