UCSF

ZINC31963665

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 22 Yes

Download: MOL2 SDF SMILES Flexibase

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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) 2.08 5.2 -59.2 4 5 1 79 320.438 7
Hi High (pH 8-9.5) 2.26 4.13 -58 3 5 0 85 319.43 7

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