UCSF

ZINC16951178

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 10 No

Popular Name: VAL-083 VAL-083

Find On: PubMed — Wikipedia — Google

CAS Number: 23261-20-3

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) -1.31 -4.88 -8.46 2 4 0 66 146.142 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0300526A2; EP0349066A1; EP0349066B1; EP0397803B1; EP0417128A1; EP0494967A1; EP0540690A1; EP0540690B1; EP0560898A1; EP0560898B1; EP0613475A1; EP0613475B1; EP0628064A1; EP0628064B1; EP0899282A2; US3957702; US4013696; US4585858; US4931220; US4931221; US493 IBM Patent Data

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