UCSF

ZINC49590083

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 50 No

Popular Name: 3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propyl]amino]-3-(4-hydroxyphenyl)prop 3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(…

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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) 2.23 1.08 -246.43 15 11 3 209 687.906 22 ↓
Hi High (pH 8-9.5) 2.23 -1.25 -70.68 13 11 1 200 685.89 22 ↓
Mid Mid (pH 6-8) 2.23 0.1 -121.03 14 11 2 204 686.898 22 ↓
Lo Low (pH 4.5-6) 2.23 3.3 -672.68 17 11 5 218 689.922 22 ↓
Lo Low (pH 4.5-6) 2.23 2.17 -419.6 16 11 4 213 688.914 22 ↓
Lo Low (pH 4.5-6) 2.23 2.21 -434.96 16 11 4 213 688.914 22 ↓
Lo Low (pH 4.5-6) 2.23 2.1 -501.12 16 11 4 213 688.914 22 ↓

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