UCSF

ZINC03845913

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 12 Yes

Popular Name: [3-(hydroxymethyl)-1,2,2-trimethyl-cyclopentyl]methanol [3-(hydroxymethyl)-1,2,2-trimeth…

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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) 1.59 0.03 -4.4 2 2 0 40 172.268 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4952740 IBM Patent Data

Activity (Go SEA)

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