In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 23 | No |
Popular Name: (5R)-9-chloro-5-phenyl-3-propyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol (5R)-9-chloro-5-phenyl-3-propyl-…
None
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) | 4.25 | 7.67 | -36.83 | 3 | 3 | 1 | 45 | 332.851 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 8.47 | -62.63 | 2 | 3 | 0 | 48 | 331.843 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 6.1 | -5.75 | 2 | 3 | 0 | 44 | 331.843 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 8.46 | -52.9 | 2 | 3 | 0 | 48 | 331.843 | 3 | ↓ |