UCSF

ZINC41660938

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 34 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) 4.80 11.12 -11.44 0 5 0 56 446.506 4
Lo Low (pH 4.5-6) 4.80 11.59 -44.74 1 5 1 57 447.514 4

Activity (Go SEA)

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