UCSF

ZINC02513960

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 Yes

Popular Name: Decanhydroisoquinoline-3-carboxylic acid Decanhydroisoquinoline-3-carboxy…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 115238-58-9 , 82717-30-4

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) 0.16 4.62 -37.78 2 3 0 57 183.251 1 ↓

Activity (Go SEA)

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