UCSF

ZINC08214418

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 2006 32 No

Popular Name: FDA FDA

Find On: PubMed — Wikipedia — Google

CAS Number: 107793-72-6

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) -2.34 -16.91 -15.69 7 11 0 179 791.115 11 ↓

Activity (Go SEA)

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

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