UCSF

ZINC37085244

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 19 Yes

Download: MOL2 SDF SMILES Flexibase

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) 3.02 6.53 -6.61 1 3 0 38 275.27 6
Mid Mid (pH 6-8) 3.02 7.36 -39.8 2 3 1 43 276.278 6

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Rings

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