UCSF

ZINC44713506

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2010 17 Yes

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) 2.21 8.26 -7 0 4 0 42 234.299 4
Lo Low (pH 4.5-6) 2.21 8.73 -33.99 1 4 1 44 235.307 4

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