UCSF

ZINC63743468

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 5th, 2011 27 Yes

Popular Name: (4R)-N-[3-[2-[(2S)-3-methyl-1,2-dihydrobenzimidazol-2-yl]ethyl]phenyl]-4H-imidazole-4-sulfonamide (4R)-N-[3-[2-[(2S)-3-methyl-1,2-…

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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) 3.03 6.44 -49.62 3 7 0 93 383.477 6 ↓
Hi High (pH 8-9.5) 3.03 5.92 -47.94 2 7 -1 92 382.469 6 ↓
Mid Mid (pH 6-8) 3.03 6.7 -74.31 4 7 1 95 384.485 6 ↓

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

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