In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1R,5S)-3-(aminomethyl)-N-cyclopropyl-8-methyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-3-(aminomethyl)-N-cyclop…
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) | 1.26 | 4.04 | -25.19 | 3 | 3 | 1 | 34 | 252.426 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.26 | 6.64 | -101.89 | 4 | 3 | 2 | 35 | 253.434 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 6.76 | -88.07 | 4 | 3 | 2 | 35 | 253.434 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 4.28 | -46.65 | 3 | 3 | 1 | 34 | 252.426 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.