UCSF

ZINC32141208

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 21 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.93 4.82 -50.7 2 5 1 57 289.355 8
Mid Mid (pH 6-8) 1.93 3.39 -8.42 1 5 0 53 288.347 8

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