UCSF

ZINC34846630

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 5.77 7.18 -8.88 2 5 0 75 433.327 3
Hi High (pH 8-9.5) 6.23 5.09 -47.31 1 5 -1 78 432.319 3
Hi High (pH 8-9.5) 5.77 8.09 -41.04 1 5 -1 78 432.319 3

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