UCSF

ZINC62027320

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 26 Yes

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) 4.53 6.22 -11.32 2 5 0 75 372.49 4
Mid Mid (pH 6-8) 4.53 6.25 -42.3 1 5 -1 77 371.482 4

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

No pre-computed analogs available. Try a structural similarity search.