UCSF

ZINC31702802

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2009 27 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) -0.12 -3.23 -26.06 3 10 0 148 398.393 5
Hi High (pH 8-9.5) 0.34 -4.93 -66.18 2 10 -1 151 397.385 5

Activity (Go SEA)

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