UCSF

ZINC61441079

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2011 18 No

Popular Name: 4-[(5-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]thiadiazol-5-amine 4-[(5-methyl-1H-benzimidazol-2-y…

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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) 2.81 3.15 -11.43 3 5 0 80 277.378 3 ↓
Lo Low (pH 4.5-6) 2.81 3.53 -33.73 4 5 1 82 278.386 3 ↓

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

No pre-computed analogs available. Try a structural similarity search.