UCSF

ZINC03875546

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 24 No

Popular Name: Coumachlor Coumachlor

Find On: PubMed — Wikipedia — Google

CAS Number: 81-82-3

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) 3.71 10.27 -42.21 0 4 -1 70 341.77 4 ↓
Mid Mid (pH 6-8) 3.71 9.02 -10.82 1 4 0 68 342.778 4 ↓
Lo Low (pH 4.5-6) 3.71 9.82 -21.81 1 4 0 68 342.778 4 ↓

Activity (Go SEA)

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

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