In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 20 | Yes |
Popular Name: 4-amino-N-propyl-N-(p-tolylmethyl)-1H-pyrrole-2-carboxamide 4-amino-N-propyl-N-(p-tolylmethy…
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) | 2.67 | 7.31 | -10.72 | 3 | 4 | 0 | 62 | 271.364 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 6.29 | -50.95 | 3 | 4 | 1 | 60 | 272.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.