UCSF

ZINC44223151

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 18 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) 1.95 5.91 -100.93 1 5 -2 96 243.218 3
Lo Low (pH 4.5-6) 1.95 5.46 -49.38 2 5 -1 93 244.226 3

Activity (Go SEA)

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