In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 19 | Yes |
Popular Name: (2S,4S)-2-(m-tolyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-4-ol (2S,4S)-2-(m-tolyl)-2,3,4,5-tetr…
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) | 3.42 | 6.56 | -4.09 | 2 | 2 | 0 | 32 | 253.345 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.42 | 6.53 | -34.39 | 3 | 2 | 1 | 37 | 254.353 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.