In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 16 | Yes |
Popular Name: (1S,2R)-2-[[methyl-[(2-methyl-3-furyl)methyl]amino]methyl]cyclopentanol (1S,2R)-2-[[methyl-[(2-methyl-3-…
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) | 1.54 | 5.2 | -35.62 | 2 | 3 | 1 | 38 | 224.324 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 2.93 | -4.56 | 1 | 3 | 0 | 37 | 223.316 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.