UCSF

ZINC00066428

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 No

Other Names:

BRD-K75938343-001-01-0

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) 0.93 4.53 -11.23 2 4 0 50 233.296 5
Lo Low (pH 4.5-6) 0.93 4.82 -40.38 3 4 1 51 234.304 5

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.