UCSF

ZINC36230709

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 21 No

Popular Name: N-[[3-nitro-4-[[(2S)-tetrahydropyran-2-yl]methoxy]phenyl]methyl]ethanamine N-[[3-nitro-4-[[(2S)-tetrahydrop…

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) 2.70 8.25 -56.81 2 6 1 81 295.359 7 ↓

Activity (Go SEA)

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