UCSF

ZINC00000113

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 20 No

Popular Name: Cadralazine Cadralazine

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CAS Numbers: 64241-34-5 , [64241-34-5]

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) 1.15 2.48 -12.44 3 8 0 100 283.332 8 ↓
Lo Low (pH 4.5-6) 1.15 2.58 -32.95 4 8 1 101 284.34 8 ↓

Vendor Notes

Note Type Comments Provided By
Indications antihypertensive KeyOrganics Bioactives

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Rings

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