| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 13th, 2009 | 24 | No |
Popular Name: (5S)-3-allyl-9-chloro-5-(3-chlorophenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol (5S)-3-allyl-9-chloro-5-(3-chlor…
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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) | 4.67 | 8.05 | -45.5 | 3 | 3 | 1 | 45 | 365.28 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 5.76 | -5.78 | 2 | 3 | 0 | 44 | 364.272 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 6.54 | -39.47 | 1 | 3 | -1 | 47 | 363.264 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.67 | 8.83 | -58.78 | 2 | 3 | 0 | 48 | 364.272 | 3 | ↓ |
