UCSF

ZINC00206157

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 14 Yes

Popular Name: 2-(1H-tetrazol-1-yl)benzoic acid 2-(1H-tetrazol-1-yl)benzoic acid

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CAS Number: 116570-12-8

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) 0.33 5.36 -66.26 0 6 -1 84 189.154 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 190 - 194 Enamine Building Blocks
MP 191 - 193 Enamine Building Blocks
MP 191...193 Enamine Building Blocks
MP 195 - 197 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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