UCSF

ZINC36194375

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 12 Yes

Popular Name: 4-isopropoxy-3-methyl-phenol 4-isopropoxy-3-methyl-phenol

Find On: PubMed — Wikipedia — Google

CAS Number: 1216201-65-8

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) 2.63 3.22 -4.42 1 2 0 29 166.22 2 ↓

Activity (Go SEA)

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