UCSF

ZINC02566075

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 10 Yes

Popular Name: 3-CHLORO-4-METHYLBENZYL ALCOHOL 3-CHLORO-4-METHYLBENZYL ALCOHOL

Find On: PubMed — Wikipedia — Google

CAS Number: 39652-32-9

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) 2.33 -1.19 -4.53 1 1 0 20 156.612 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 80% Fluorochem
PUBCHEM_PATENT_ID US4870097 IBM Patent Data

Activity (Go SEA)

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