UCSF

ZINC00817570

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 28 No

Other Names:

MFCD00609647

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) 2.69 6.11 -14.76 1 7 0 76 378.432 4
Lo Low (pH 4.5-6) 2.69 8.43 -50.88 2 7 1 77 379.44 4
Lo Low (pH 4.5-6) 2.69 8.27 -53.01 2 7 1 77 379.44 4

Activity (Go SEA)

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