UCSF

ZINC06352860

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 27 No

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) 6.53 11.68 -7.71 1 4 0 48 399.947 5
Mid Mid (pH 6-8) 6.53 12.08 -33.64 2 4 0 50 400.955 5
Mid Mid (pH 6-8) 6.53 11.76 -33.42 2 4 0 50 400.955 5

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