UCSF

ZINC02468940

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2004 24 No

Popular Name: (1S,2R)-N-allyl-N'-(3-nitrophenyl)cyclohex-4-ene-1,2-dicarboxamide (1S,2R)-N-allyl-N'-(3-nitropheny…

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) 2.46 -0.4 -14.89 2 7 0 104 329.356 6 ↓

Activity (Go SEA)

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