UCSF

ZINC11958346

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2008 14 Yes

Popular Name: (S)-2-Amino-N-furan-2-ylmethyl-3-methyl-butyramide (S)-2-Amino-N-furan-2-ylmethyl-3…

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CAS Numbers: 1217713-22-8 , 1236256-49-7 , 1423040-92-9 , 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) 0.06 1.62 -44.18 4 4 1 70 197.258 4 ↓
Hi High (pH 8-9.5) 0.06 1.34 -6.54 3 4 0 68 196.25 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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