UCSF

ZINC14632363

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2008 17 Yes

Popular Name: MFCD08688099 MFCD08688099

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CAS Numbers: 1220031-83-3 , 946715-86-2 , N/A

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) 2.51 5.59 -44.61 2 3 1 35 236.335 5 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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