UCSF

ZINC59416071

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2011 35 No

Popular Name: (5S,6R)-6-[1-methyl-1-[(4-nitrophenyl)methoxycarbonyloxy]ethyl]-3-(1-methyltetrazol-5-yl)sulfanyl-7- (5S,6R)-6-[1-methyl-1-[(4-nitrop…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.74 7.37 -59.53 0 14 -1 185 503.473 10 ↓

Activity (Go SEA)

Rings

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

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