UCSF

ZINC19782451

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2008 22 No

Other Names:

MFCD01191723

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) -0.19 4 -16.85 0 6 0 61 305.309 2
Ref Reference (pH 7) -0.19 3.98 -16.99 0 6 0 61 305.309 2
Mid Mid (pH 6-8) -0.19 6.36 -58.64 1 6 1 62 306.317 2

Activity (Go SEA)

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