UCSF

ZINC36611143

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2009 37 No

Popular Name: (4R,4aR,6R)-2-amino-4-(4-benzyloxy-3-methoxy-phenyl)-6-tert-butyl-4a,5,6,7-tetrahydro-4H-naphthalene (4R,4aR,6R)-2-amino-4-(4-benzylo…

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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) 6.19 12.81 -14.15 2 6 0 116 492.623 6 ↓
Lo Low (pH 4.5-6) 6.19 12.63 -49.55 3 6 1 117 493.631 6 ↓

Activity (Go SEA)

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