UCSF

ZINC03874605

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 36 No

Popular Name: PANTETHINE PANTETHINE

Find On: PubMed — Wikipedia — Google

CAS Number: 16816-67-4

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) -1.93 -15.59 -38.43 8 12 0 197 554.732 19 ↓

Vendor Notes

Note Type Comments Provided By
Therapy antilipemic SMDC Pharmakon
PUBCHEM_PATENT_ID EP0131995A1; EP0200208A2; EP0200208B1; EP0223257A2; EP0223257B1; EP0231925A2; EP0281394A2; EP0313302A2; EP0313302B1; EP0313303A2; EP0313303B1; EP0313304A2; EP0313304B1; EP0313305A2; EP0313347A2; EP0316438B1; EP0323855A2; EP0323855B1; EP0330369A1; EP042501 IBM Patent Data

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

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