In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 17 | Yes |
Popular Name: (1S)-N-(cyclobutylmethyl)-1-(4-fluorophenyl)-N-methyl-ethane-1,2-diamine (1S)-N-(cyclobutylmethyl)-1-(4-f…
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) | 1.94 | 5.17 | -51.65 | 3 | 2 | 1 | 31 | 237.342 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.94 | 7.01 | -126.29 | 4 | 2 | 2 | 32 | 238.35 | 5 | ↓ |