UCSF

ZINC19815604

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2008 22 Yes

Other Names:

MFCD01928416

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) -0.28 1.58 -14.64 1 6 0 60 304.394 4
Mid Mid (pH 6-8) -0.28 3.98 -34.18 2 6 1 61 305.402 4

Activity (Go SEA)

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