In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 14 | Yes |
Popular Name: N-(1H-imidazol-5-ylmethyl)-1-[(3S)-1-methylpyrrolidin-3-yl]methanamine N-(1H-imidazol-5-ylmethyl)-1-[(3…
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) | 0.26 | 4.34 | -77.31 | 4 | 4 | 2 | 46 | 196.298 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 3.88 | -36.19 | 3 | 4 | 1 | 45 | 195.29 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.