UCSF

ZINC34933818

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 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) 3.86 9.07 -20.57 1 8 0 112 465.959 7
Hi High (pH 8-9.5) 3.86 8.57 -42.17 0 8 -1 114 464.951 7

Activity (Go SEA)

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