UCSF

ZINC13305068

Substance Information

In ZINC since Heavy atoms Benign functionality
June 16th, 2008 23 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 3.26 4.74 -4.8 1 4 0 42 327.509 6
Mid Mid (pH 6-8) 3.26 7.03 -37.16 2 4 1 43 328.517 6

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