UCSF

ZINC78931563

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2012 18 Yes

Other Names:

MFCD27967422

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) -0.65 -2.14 -51.81 5 5 1 86 255.269 3
Mid Mid (pH 6-8) -0.65 -2.45 -8.33 4 5 0 85 254.261 3

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

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