In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 24 | Yes |
Popular Name: (5S)-2-[(E)-3-(4-fluorophenyl)prop-2-enyl]-9-(2-methoxyethyl)-2,9-diazaspiro[4.5]decane (5S)-2-[(E)-3-(4-fluorophenyl)pr…
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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) | 3.48 | 9.75 | -43.37 | 1 | 3 | 1 | 17 | 333.471 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.48 | 7.25 | -4.03 | 0 | 3 | 0 | 16 | 332.463 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 9.18 | -36.11 | 1 | 3 | 1 | 17 | 333.471 | 6 | ↓ |