UCSF

ZINC37713026

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2009 16 Yes

Popular Name: N-[(1R)-1,2-bis(2-thienyl)ethyl]ethane-1,2-diamine N-[(1R)-1,2-bis(2-thienyl)ethyl]…

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) 2.09 4.03 -41.37 4 2 1 40 253.416 6 ↓
Lo Low (pH 4.5-6) 2.09 5.22 -110.88 5 2 2 44 254.424 6 ↓

Activity (Go SEA)

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