In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 23 | Yes |
Popular Name: (4S)-4-phenyl-2-(3-pyridylmethyl)-3,4-dihydro-1H-isoquinoline (4S)-4-phenyl-2-(3-pyridylmethyl…
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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) | 3.28 | 9.58 | -5.43 | 0 | 2 | 0 | 16 | 300.405 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 11.86 | -44.41 | 1 | 2 | 1 | 17 | 301.413 | 3 | ↓ |