UCSF

ZINC08858602

Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2007 32 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) 2.04 7.23 -58.37 2 8 1 94 441.504 8
Mid Mid (pH 6-8) 1.45 7.95 -66.58 1 8 1 90 441.504 8

Activity (Go SEA)

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