UCSF

ZINC32109047

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2009 19 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) 2.27 8.23 -52.56 0 4 -1 58 255.297 3
Lo Low (pH 4.5-6) 2.27 7.14 -11.67 1 4 0 55 256.305 3

Activity (Go SEA)

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