In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1S,5R)-3-(aminomethyl)-N-cyclopentyl-N,8-dimethyl-8-azabicyclo[3.2.1]octan-3-amine (1S,5R)-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) | 1.41 | 4.13 | -116.44 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 6.59 | -29.37 | 3 | 3 | 1 | 34 | 252.426 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 6.59 | -100.04 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 4.26 | -46.07 | 3 | 3 | 1 | 34 | 252.426 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.41 | 6.51 | -206.29 | 5 | 3 | 3 | 37 | 254.442 | 3 | ↓ |