UCSF

ZINC08703801

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 16 Yes

Popular Name: MFCD11052217 MFCD11052217

Find On: PubMed — Wikipedia — Google

CAS Number: 946676-66-0

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) 2.99 -0.53 -52.6 0 3 -1 43 218.276 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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