UCSF

ZINC06983474

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2006 25 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) 1.70 6.75 -55.47 2 5 1 68 361.487 7
Hi High (pH 8-9.5) 1.70 4.28 -19.01 1 5 0 66 360.479 7

Activity (Go SEA)

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