UCSF

ZINC04166527

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 14 No

Other Names:

BRD-K03463894-001-02-7

Download: MOL2 SDF SMILES Flexibase

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 1.39 -48.92 2 5 -1 98 195.15 2
Hi High (pH 8-9.5) 1.30 2.41 -105.7 1 5 -2 100 194.142 2

Activity (Go SEA)

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