In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 18 | Yes |
Popular Name: 2-(aminomethyl)-4-chloro-N-(cyclohexylmethyl)-N-methyl-aniline 2-(aminomethyl)-4-chloro-N-(cycl…
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) | 4.12 | 8.24 | -44.76 | 3 | 2 | 1 | 31 | 267.824 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.12 | 7.83 | -1.56 | 2 | 2 | 0 | 29 | 266.816 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.