UCSF

ZINC34686270

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 36 Yes

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) 1.30 6.16 -19.55 0 9 0 81 497.592 9
Mid Mid (pH 6-8) 1.30 8.43 -51.27 1 9 1 82 498.6 9

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