UCSF

ZINC00084088

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

Popular Name: Chlormidazole Chlormidazole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3689-76-7 , 54118-67-1 , 74298-63-8

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) 3.86 9.88 -10.4 0 2 0 18 256.736 2 ↓
Lo Low (pH 4.5-6) 3.86 10.32 -31.74 1 2 1 19 257.744 2 ↓

Vendor Notes

Note Type Comments Provided By
Therapy antifungal SMDC Pharmakon

Activity (Go SEA)

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