UCSF

ZINC07660217

Substance Information

In ZINC since Heavy atoms Benign functionality
June 10th, 2006 23 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 3.51 7.05 -47.93 3 5 1 63 385.326 7
Mid Mid (pH 6-8) 3.51 4.86 -15.65 2 5 0 61 384.318 7

Activity (Go SEA)

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