UCSF

ZINC20366680

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 19 Yes

Other Names:

MFCD01316211

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.36 6.43 -23.65 1 3 1 21 256.373 1
Hi High (pH 8-9.5) 3.36 6.16 -7.03 0 3 0 19 255.365 1
Mid Mid (pH 6-8) 3.36 8.9 -88.88 2 3 2 22 257.381 1

Activity (Go SEA)

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