UCSF

ZINC39917603

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 28 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) 4.03 9.69 -10.06 0 5 0 40 379.504 8
Mid Mid (pH 6-8) 4.03 11.96 -45.78 1 5 1 41 380.512 8
Lo Low (pH 4.5-6) 4.03 12.26 -99.58 2 5 2 42 381.52 8

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