UCSF

ZINC08649154

Substance Information

In ZINC since Heavy atoms Benign functionality
July 6th, 2007 15 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) -0.01 -4.76 -39.13 3 8 -1 134 243.253 2
Mid Mid (pH 6-8) -0.47 -2.93 -10.37 4 8 0 130 244.261 2

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

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