UCSF

ZINC04637948

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 16th, 2005 16 Yes

Popular Name: MFCD02043656 MFCD02043656

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CAS Number: 1177338-16-7

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) -2.65 -4.9 -46.2 3 8 -1 130 227.2 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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