UCSF

ZINC08695347

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2007 38 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) 7.42 3.64 -51.81 2 5 1 62 523.713 14
Mid Mid (pH 6-8) 6.84 3.55 -63.28 1 5 1 58 523.713 14

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