UCSF

ZINC95864338

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 16 No

Other Names:

MFCD06202361

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) -1.44 4.22 -36.36 3 4 0 81 238.674 3
Mid Mid (pH 6-8) -1.44 3.94 -44.69 2 4 -1 79 237.666 3

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

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