UCSF

ZINC39917617

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 30 Yes

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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) 4.78 11.13 -12.73 0 5 0 40 427.976 10
Mid Mid (pH 6-8) 4.78 13.39 -49.56 1 5 1 41 428.984 10
Mid Mid (pH 6-8) 4.78 11.56 -35.21 1 5 1 41 428.984 10
Lo Low (pH 4.5-6) 4.78 13.82 -102.18 2 5 2 42 429.992 10

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