UCSF

ZINC39916146

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 24 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) 1.00 0.19 -38.85 4 6 1 84 415.251 12
Mid Mid (pH 6-8) 3.94 11.86 -47.63 2 5 1 51 391.539 8

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