UCSF

ZINC02801761

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 34 No

Popular Name: (4S,4aS)-2-amino-4-[3-[(3-bromophenoxy)methyl]-4-methoxy-phenyl]-4a,5,6,7-tetrahydro-4H-naphthalene- (4S,4aS)-2-amino-4-[3-[(3-bromop…

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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) 6.04 10.99 -12.74 2 6 0 116 515.411 5 ↓
Lo Low (pH 4.5-6) 6.04 10.84 -48.68 3 6 1 117 516.419 5 ↓

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Rings

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

No pre-computed analogs available. Try a structural similarity search.