UCSF

ZINC08742175

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2007 33 No

Popular Name: 2-amino-4-(3-isopropoxy-4-methoxy-phenyl)-6-tert-butyl-4a,5,6,7-tetrahydro-4H-naphthalene-1,1,3-tric 2-amino-4-(3-isopropoxy-4-methox…

Find On: PubMed — Wikipedia — Google

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) 5.33 10.97 -10.68 2 6 0 116 444.579 5 ↓
Mid Mid (pH 6-8) 5.42 4.32 -44.27 2 6 1 115 445.587 5 ↓

Activity (Go SEA)

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