UCSF

ZINC49499435

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2010 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) -3.25 -2.81 -266.64 5 16 -3 250 456.221 6
Mid Mid (pH 6-8) -3.25 -3.96 -144.99 6 16 -2 247 457.229 6

Activity (Go SEA)

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