UCSF

ZINC33824587

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 17 Yes

Popular Name: 4-(2-((Phenylmethyl)amino)ethyl)phenol hydrochloride; LS-105062; Phenol, 4-(2-((phenylmethyl)amino)ethyl)-, hydrochloride; Phenol, 4-(2-(benzylamino)ethyl)-, hydrochloride 4-(2-((Phenylmethyl)amino)ethyl)…

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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) 2.82 6.14 -48.06 3 2 1 37 228.315 5 ↓
Mid Mid (pH 6-8) 2.82 4.73 -6.85 2 2 0 32 227.307 5 ↓

Activity (Go SEA)

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