UCSF

ZINC08817963

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 33 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) 2.10 5.85 -58.68 3 8 1 101 453.515 8
Mid Mid (pH 6-8) 1.52 6.52 -70.15 2 8 1 98 453.515 8

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