UCSF

ZINC02596112

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2004 24 Yes

Popular Name: 2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid 2-[(4-fluorobenzoyl)amino]-3-(1H…

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CAS Numbers: 1396966-66-7 , 1397321-16-2 , 39545-02-3

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) 1.03 8.57 -59.49 2 5 -1 85 325.319 5 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
MP 95 - 98 Enamine Building Blocks
MP 95...98 Enamine Building Blocks

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