In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 20 | Yes |
Popular Name: 2-(aminomethyl)-3-chloro-N-methyl-N-(3-phenylpropyl)aniline 2-(aminomethyl)-3-chloro-N-methy…
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) | 4.13 | 9.68 | -41.22 | 3 | 2 | 1 | 31 | 289.83 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.13 | 9.28 | -3.72 | 2 | 2 | 0 | 29 | 288.822 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.