UCSF

ZINC61441084

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2011 19 Yes

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

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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) 3.18 4.18 -11.26 2 5 0 66 291.405 4 ↓
Lo Low (pH 4.5-6) 3.18 4.56 -33.04 3 5 1 68 292.413 4 ↓

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

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