In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 21 | No |
Popular Name: (4R)-2-methyl-1-[(3-nitrophenyl)methyl]-4,5,6,7-tetrahydroindol-4-amine (4R)-2-methyl-1-[(3-nitrophenyl)…
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) | 0.91 | 8.6 | -44.39 | 3 | 5 | 1 | 78 | 286.355 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.91 | 8.28 | -10.02 | 2 | 5 | 0 | 77 | 285.347 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.