UCSF

ZINC02391612

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 33 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) 6.12 11.85 -11.43 2 7 0 97 549.208 7
Hi High (pH 8-9.5) 6.30 11.05 -46.14 1 7 -1 103 548.2 7

Activity (Go SEA)

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