UCSF

ZINC69737623

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 23 Yes

Popular Name: (1R,4R,5R)-N-[3-(morpholinomethyl)phenyl]bicyclo[2.2.1]hept-2-ene-5-carboxamide (1R,4R,5R)-N-[3-(morpholinomethy…

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) 2.64 6.04 -9.84 1 4 0 42 312.413 4 ↓
Lo Low (pH 4.5-6) 2.64 8.3 -45.29 2 4 1 43 313.421 4 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.