UCSF

ZINC49014432

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2010 15 No

Popular Name: 3-amino-N-methyl-N-[(1S,3R)-3-methylcyclohexyl]-3-thioxo-propanamide 3-amino-N-methyl-N-[(1S,3R)-3-me…

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) 0.76 4.9 -16.79 2 3 0 46 228.361 3 ↓

Activity (Go SEA)

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