UCSF

ZINC12274870

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 11th, 2008 23 No

Popular Name: BRD-K65968546-001-01-4 BRD-K65968546-001-01-4

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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) 4.52 9.45 -49.31 0 5 -1 74 343.409 3 ↓
Ref Reference (pH 7) 4.52 9.03 -50.77 0 5 -1 74 343.409 3 ↓

Activity (Go SEA)

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