In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 27 | Yes |
Popular Name: 4-[[(3S)-3-(2-hydroxyethyl)-4-(o-tolylmethyl)piperazin-1-yl]methyl]-2-methoxy-phenol 4-[[(3S)-3-(2-hydroxyethyl)-4-(o…
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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) | 2.40 | 5.34 | -47.68 | 3 | 5 | 1 | 57 | 371.501 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 4.94 | -40.48 | 3 | 5 | 1 | 57 | 371.501 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 3.08 | -8.2 | 2 | 5 | 0 | 56 | 370.493 | 7 | ↓ |