UCSF

ZINC08846548

Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2007 31 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) 4.52 0.27 -11.74 1 5 0 71 436.474 7
Mid Mid (pH 6-8) 5.10 2.15 -35.71 3 5 1 76 437.482 6

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