In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 4-(aminomethyl)-N-cyclopropyl-N-(3-thienylmethyl)pyridin-2-amine 4-(aminomethyl)-N-cyclopropyl-N-…
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) | 1.63 | 6.36 | -53.08 | 3 | 3 | 1 | 44 | 260.386 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.63 | 5.97 | -5.51 | 2 | 3 | 0 | 42 | 259.378 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.63 | 6.5 | -27.83 | 3 | 3 | 1 | 43 | 260.386 | 5 | ↓ |