UCSF

ZINC00897178

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 13 No

Popular Name: Isosorbide-2-mononitrate Isosorbide-2-mononitrate

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CAS Number: 16106-20-0

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) -0.05 0.39 -7.07 1 7 0 94 191.139 2 ↓

Vendor Notes

Note Type Comments Provided By
biological_use Cardiant IBScreen Bioactives
mechanism Effector of EDRF IBScreen Bioactives

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