UCSF

ZINC09271383

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 35 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 3.73 9.47 -42.49 2 8 1 90 483.585 11
Mid Mid (pH 6-8) 2.70 1.59 -39.85 1 8 1 86 483.585 12

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