UCSF

ZINC00382662

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 20 Yes

Other Names:

MFCD03710346

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) 2.73 5.01 -9.08 0 5 0 61 267.288 4
Lo Low (pH 4.5-6) 2.73 5.48 -41.29 1 5 1 62 268.296 4

Activity (Go SEA)

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

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