UCSF

ZINC39355702

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2010 37 Yes

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) 3.91 12.16 -114.93 2 8 2 85 525.049 5
Hi High (pH 8-9.5) 3.91 10 -38.1 1 8 1 84 524.041 5

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