UCSF

ZINC34234519

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2009 29 No

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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) 4.29 6.84 -57.04 1 6 -1 91 451.3 2
Lo Low (pH 4.5-6) 3.83 9.51 -13.83 2 6 0 88 452.308 2

Activity (Go SEA)

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