UCSF

ZINC32232145

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 21 No

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Annotations

Vendors

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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) 1.28 1.16 -11.88 2 7 0 91 314.363 4
Lo Low (pH 4.5-6) 1.28 0.77 -54.65 3 7 1 93 315.371 4

Activity (Go SEA)

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