In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 16 | Yes |
Popular Name: (2R)-N1-[(1S)-2,2-dimethylcyclopropyl]-2-phenyl-propane-1,2-diamine (2R)-N1-[(1S)-2,2-dimethylcyclop…
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) | 2.47 | 5.87 | -33.61 | 4 | 2 | 1 | 43 | 219.352 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 6.25 | -125.12 | 5 | 2 | 2 | 44 | 220.36 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.