UCSF

ZINC00000363

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 23 No

Popular Name: ium ium

Find On: PubMed — Wikipedia — Google

CAS Numbers: 115-63-9 , 6004-98-4

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) -0.43 9.3 -31.6 1 3 1 23 317.497 4 ↓
Mid Mid (pH 6-8) -0.43 10.45 -108.04 2 3 2 25 318.505 4 ↓

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