UCSF

ZINC39340956

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 13 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) 2.12 7.09 -51.58 0 2 -1 40 173.191 1
Lo Low (pH 4.5-6) 2.12 5.07 -5.91 1 2 0 37 174.199 1

Activity (Go SEA)

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