In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | Yes |
Popular Name: (1S,5R,6S)-N-[[4-(diethylaminomethyl)phenyl]methyl]bicyclo[3.2.0]hept-3-en-6-amine (1S,5R,6S)-N-[[4-(diethylaminome…
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) | 3.56 | 11.43 | -86.39 | 3 | 2 | 2 | 21 | 286.463 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 9.29 | -38.14 | 2 | 2 | 1 | 20 | 285.455 | 7 | ↓ |