UCSF

ZINC39963344

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2010 23 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) 0.49 6.95 -24.13 1 5 0 64 327.771 4
Lo Low (pH 4.5-6) 0.49 7.41 -62.88 2 5 1 65 328.779 4

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