UCSF

ZINC03995472

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2005 16 Yes

Popular Name: KU14R KU14R

Find On: PubMed — Wikipedia — Google

CAS Numbers: 189224-48-4 , 698970-35-3

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) 2.61 6.43 -7.38 1 3 0 38 214.268 2 ↓
Mid Mid (pH 6-8) 2.61 6.83 -30.35 2 3 1 39 215.276 2 ↓

Activity (Go SEA)

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