UCSF

ZINC43273030

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 11th, 2010 25 Yes

Popular Name: N-allyl-2-[4-[(5-chloro-1-methyl-benzimidazol-2-yl)methyl]piperazin-1-yl]acetamide N-allyl-2-[4-[(5-chloro-1-methyl…

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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) 2.20 6.26 -47.26 2 6 1 55 362.885 6 ↓
Mid Mid (pH 6-8) 2.20 4.71 -33.32 2 6 1 55 362.885 6 ↓
Mid Mid (pH 6-8) 2.20 4.08 -13 1 6 0 53 361.877 6 ↓
Mid Mid (pH 6-8) 2.20 6.34 -44.91 2 6 1 55 362.885 6 ↓
Lo Low (pH 4.5-6) 2.20 6.89 -91.19 3 6 2 56 363.893 6 ↓

Activity (Go SEA)

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