UCSF

ZINC08779440

Substance Information

In ZINC since Heavy atoms Benign functionality
July 27th, 2007 36 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) 1.63 0.43 -54.59 2 10 1 112 501.556 10
Mid Mid (pH 6-8) 1.05 0.38 -63.67 1 10 1 108 501.556 10

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