UCSF

ZINC12138100

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 27th, 2008 14 Yes

Popular Name: 3-Amino-N-(sec-butyl)benzamide 3-Amino-N-(sec-butyl)benzamide

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CAS Numbers: , 81882-63-5

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) 1.39 3.26 -8.84 3 3 0 55 192.262 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 87-89° Matrix Scientific
Warnings IRRITANT Matrix Scientific

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