UCSF

ZINC19831692

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 20 Yes

Popular Name: [2-(morpholin-4-ylmethyl)-1H-benzimidazol-1-yl]acetic acid [2-(morpholin-4-ylmethyl)-1H-ben…

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CAS Numbers: 886851-65-6 , [886851-65-6]

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) 0.50 4.22 -48.02 0 6 -1 70 274.3 4 ↓
Mid Mid (pH 6-8) 0.50 4.62 -41.15 1 6 0 72 275.308 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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