UCSF

ZINC00113222

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 16 Yes

Popular Name: 2-[(Furan-2-ylmethyl)-amino]-benzoic acid 2-[(Furan-2-ylmethyl)-amino]-ben…

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CAS Number: 501661-50-3

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) 2.49 6.05 -51.61 1 4 -1 65 216.216 4 ↓
Lo Low (pH 4.5-6) 2.49 4.06 -8.39 2 4 0 62 217.224 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 156 - 158 Enamine Building Blocks
MP 156...158 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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