UCSF

ZINC55831898

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2010 22 No

CAS Number: 58880-19-6

Other Names:

Trichostatin A

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) 2.68 6.11 -19.09 2 5 0 70 302.374 6
Hi High (pH 8-9.5) 2.68 7.33 -59.16 1 5 -1 72 301.366 6

Activity (Go SEA)

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

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