UCSF

ZINC35267337

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2009 32 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) 4.89 12.26 -27 1 6 0 75 448.592 5
Hi High (pH 8-9.5) 5.07 10.24 -63.99 0 6 -1 82 447.584 5

Activity (Go SEA)

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