UCSF

ZINC05263648

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2006 12 Yes

Other Names:

MFCD00170591

Download: MOL2 SDF SMILES Flexibase

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) 1.24 2.63 -33.1 0 4 -1 64 175.196 1
Mid Mid (pH 6-8) 1.24 2.71 -8.26 1 4 0 65 176.204 1

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

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