UCSF

ZINC08737739

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 13 No

Popular Name: 2-(Chloromethyl)-5-methoxy-1H-benzimidazole hydrochloride 2-(Chloromethyl)-5-methoxy-1H-be…

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CAS Number: 14625-40-2

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) 2.14 3.76 -8.28 1 3 0 38 196.637 2 ↓
Lo Low (pH 4.5-6) 2.14 4.21 -30.77 2 3 1 39 197.645 2 ↓

Activity (Go SEA)

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